SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'FMT'


List of Similar Pattern of Amino Acids

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 Interface HETATM RMSD Dali
Z-score		 Seq.
Identity (%)		 View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1A4L_B_DCFB853_2
(ADENOSINE DEAMINASE)		 3kmv ALPHA-L-ARABINOFURAN
OSIDASE B
(Ruminiclostridiu
m
thermocellum) 		4 / 5 HIS A  25
SER A  59
LEU A  50
GLY A  67
 FMT  A 162 (-3.8A)
None
None
None
 1.10A 1a4lB-3kmvA:
undetectable		 1a4lB-3kmvA:
19.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1B02_A_C2FA281_0
(PROTEIN (THYMIDYLATE
SYNTHASE))		 1x0a MALATE/L-LACTATE
DEHYDROGENASE FAMILY
PROTEIN
(Thermus
thermophilus) 		5 / 11 ALA A  89
TRP A 134
ASP A 172
GLY A 120
ALA A 174
 None
None
NA  A 403 (-4.6A)
None
FMT  A 401 (-3.7A)
 1.06A 1b02A-1x0aA:
undetectable		 1b02A-1x0aA:
19.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1C8L_A_CFFA940_1
(PROTEIN (GLYCOGEN
PHOSPHORYLASE))		 3ll7 PUTATIVE
METHYLTRANSFERASE
(Porphyromonas
gingivalis) 		4 / 6 PHE A 269
HIS A 295
ALA A 301
GLY A 302
 None
FMT  A 504 ( 4.1A)
None
None
 1.04A 1c8lA-3ll7A:
undetectable		 1c8lA-3ll7A:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1C9S_H_TRPH81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 10 SER A  56
GLY A 127
ALA A  58
THR A 106
THR A 130
 None
FMT  A 501 (-3.4A)
None
None
None
 1.30A 1c9sG-4kv7A:
undetectable
1c9sH-4kv7A:
undetectable		 1c9sG-4kv7A:
13.40
1c9sH-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1C9S_T_TRPT81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 2wda PUTATIVE SECRETED
LYASE
(Streptomyces
violaceoruber) 		4 / 7 GLY A 232
HIS A 244
THR A 245
THR A 191
 PEG  A1779 (-4.4A)
FMT  A1766 (-3.9A)
None
None
 0.85A 1c9sT-2wdaA:
undetectable
1c9sU-2wdaA:
undetectable		 1c9sT-2wdaA:
6.68
1c9sU-2wdaA:
6.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1C9S_T_TRPT81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		4 / 7 GLY A 127
ALA A  58
THR A 106
THR A 130
 FMT  A 501 (-3.4A)
None
None
None
 0.90A 1c9sT-4kv7A:
undetectable
1c9sU-4kv7A:
undetectable		 1c9sT-4kv7A:
13.40
1c9sU-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DMA_B_NCAB700_0
(EXOTOXIN A)		 2wvf PUTATIVE
NICKEL-RESPONSIVE
REGULATOR
(Helicobacter
pylori) 		4 / 6 GLY A 129
TYR A  72
ALA A 136
GLU A 109
 None
None
None
FMT  A1147 ( 4.5A)
 0.84A 1dmaB-2wvfA:
undetectable		 1dmaB-2wvfA:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DMI_A_BHSA1610_1
(NITRIC OXIDE
SYNTHASE)		 2yn2 UNCHARACTERIZED
PROTEIN YNL108C
(Saccharomyces
cerevisiae) 		4 / 8 ALA A 169
TRP A 242
PHE A 244
GLU A 249
 FMT  A1264 (-3.4A)
None
None
None
 1.06A 1dmiA-2yn2A:
undetectable
1dmiB-2yn2A:
undetectable		 1dmiA-2yn2A:
20.00
1dmiB-2yn2A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DZ4_A_CAMA502_0
(CYTOCHROME P450-CAM)		 1r4p SHIGA-LIKE TOXIN
TYPE II A SUBUNIT
(Escherichia
coli) 		4 / 6 PHE A  92
LEU A 159
VAL A 162
ASP A 111
 FMT  A3015 ( 4.9A)
None
FMT  A3015 (-4.4A)
None
 1.16A 1dz4A-1r4pA:
0.0		 1dz4A-1r4pA:
21.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1E7C_A_HLTA4002_1
(SERUM ALBUMIN)		 4az1 TYROSINE SPECIFIC
PROTEIN PHOSPHATASE
(Trypanosoma
cruzi) 		4 / 5 ARG A 232
ALA A 130
LYS A 129
GLU A 124
 FMT  A1302 (-3.8A)
None
FMT  A1304 (-3.2A)
None
 0.88A 1e7cA-4az1A:
undetectable		 1e7cA-4az1A:
19.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EII_A_RTLA135_0
(CELLULAR
RETINOL-BINDING
PROTEIN II)		 1r4p SHIGA-LIKE TOXIN
TYPE II A SUBUNIT
(Escherichia
coli) 		5 / 12 THR A 110
ILE A   5
THR A 165
LEU A 117
LEU A 142
 FMT  A3010 (-2.7A)
None
None
None
None
 1.07A 1eiiA-1r4pA:
0.0		 1eiiA-1r4pA:
17.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1FDS_A_ESTA350_1
(17-BETA-HYDROXYSTERO
ID-DEHYDROGENASE)		 3r3s OXIDOREDUCTASE
(Salmonella
enterica) 		5 / 12 SER A 186
LEU A 196
GLY A 230
PRO A 231
PHE A 250
 FMT  A 295 ( 2.5A)
None
NAD  A 300 (-4.7A)
NAD  A 300 (-4.9A)
None
 1.24A 1fdsA-3r3sA:
24.6		 1fdsA-3r3sA:
24.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1FDS_A_ESTA350_1
(17-BETA-HYDROXYSTERO
ID-DEHYDROGENASE)		 3r3s OXIDOREDUCTASE
(Salmonella
enterica) 		5 / 12 SER A 186
TYR A 199
GLY A 230
PRO A 231
PHE A 250
 FMT  A 295 ( 2.5A)
FMT  A 295 ( 4.2A)
NAD  A 300 (-4.7A)
NAD  A 300 (-4.9A)
None
 0.56A 1fdsA-3r3sA:
24.6		 1fdsA-3r3sA:
24.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1FDU_A_ESTA351_1
(17-BETA-HYDROXYSTERO
ID DEHYDROGENASE)		 6cmj CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2
(Homo
sapiens) 		5 / 12 VAL A 333
GLY A 332
GLY A 349
LEU A 318
SER A 316
 None
None
None
None
FMT  A 504 (-2.9A)
 1.09A 1fduA-6cmjA:
undetectable		 1fduA-6cmjA:
10.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1FK6_A_LNLA1201_1
(NON-SPECIFIC LIPID
TRANSFER PROTEIN)		 1fk1 NON-SPECIFIC LIPID
TRANSFER PROTEIN
(Zea
mays) 		12 / 12 VAL A  33
LEU A  36
ASN A  37
ALA A  40
ARG A  46
ALA A  49
LEU A  53
ALA A  57
ILE A  71
ILE A  79
TYR A  81
ILE A  83
 DAO  A 201 (-4.1A)
DAO  A 201 ( 4.6A)
DAO  A 201 (-4.0A)
DAO  A 201 ( 3.9A)
None
DAO  A 201 ( 4.0A)
None
None
DAO  A 201 ( 4.0A)
DAO  A 201 ( 4.7A)
None
FMT  A 205 ( 3.6A)
 0.36A 1fk6A-1fk1A:
21.7		 1fk6A-1fk1A:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1FML_A_RTLA401_0
(RETINOL DEHYDRATASE)		 6cmj CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2
(Homo
sapiens) 		5 / 12 TYR A 165
LEU A 263
LEU A 196
LEU A 251
ILE A 237
 None
None
FMT  A 503 (-4.3A)
None
None
 1.23A 1fmlA-6cmjA:
undetectable		 1fmlA-6cmjA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GFZ_A_CFFA940_1
(GLYCOGEN
PHOSPHORYLASE)		 3ll7 PUTATIVE
METHYLTRANSFERASE
(Porphyromonas
gingivalis) 		4 / 6 PHE A 269
HIS A 295
ALA A 301
GLY A 302
 None
FMT  A 504 ( 4.1A)
None
None
 1.00A 1gfzA-3ll7A:
3.0		 1gfzA-3ll7A:
19.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GHM_A_CEDA1_1
(BETA-LACTAMASE)		 1k38 BETA-LACTAMASE OXA-2
(Salmonella
enterica) 		6 / 12 ALA A  66
SER A  67
SER A 115
LYS A 205
GLY A 207
ARG A 244
 None
KCX  A  70 ( 2.7A)
FMT  A 401 (-2.4A)
FMT  A 401 ( 3.8A)
FMT  A 401 (-3.6A)
FMT  A 401 (-2.6A)
 0.72A 1ghmA-1k38A:
17.5		 1ghmA-1k38A:
23.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GHM_A_CEDA1_1
(BETA-LACTAMASE)		 5kzh BETA-LACTAMASE
(Acinetobacter
baumannii) 		7 / 12 ALA A  79
SER A  80
SER A 127
LYS A 217
SER A 218
GLY A 219
ARG A 260
 FMT  A 301 (-3.2A)
FMT  A 301 (-2.5A)
FMT  A 301 (-3.3A)
KCX  A  83 ( 4.9A)
None
FMT  A 301 (-3.3A)
None
 0.67A 1ghmA-5kzhA:
18.3		 1ghmA-5kzhA:
26.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GTF_L_TRPL81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 2wda PUTATIVE SECRETED
LYASE
(Streptomyces
violaceoruber) 		4 / 7 GLY A 232
HIS A 244
THR A 245
THR A 191
 PEG  A1779 (-4.4A)
FMT  A1766 (-3.9A)
None
None
 0.86A 1gtfL-2wdaA:
undetectable
1gtfM-2wdaA:
undetectable		 1gtfL-2wdaA:
6.68
1gtfM-2wdaA:
6.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GTF_L_TRPL81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		4 / 7 GLY A 127
ALA A  58
THR A 106
THR A 130
 FMT  A 501 (-3.4A)
None
None
None
 0.88A 1gtfL-4kv7A:
undetectable
1gtfM-4kv7A:
undetectable		 1gtfL-4kv7A:
13.40
1gtfM-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GTF_N_TRPN81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 2wda PUTATIVE SECRETED
LYASE
(Streptomyces
violaceoruber) 		4 / 8 GLY A 232
HIS A 244
THR A 245
THR A 191
 PEG  A1779 (-4.4A)
FMT  A1766 (-3.9A)
None
None
 0.85A 1gtfN-2wdaA:
undetectable
1gtfO-2wdaA:
undetectable		 1gtfN-2wdaA:
6.68
1gtfO-2wdaA:
6.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GTF_N_TRPN81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		4 / 8 GLY A 127
ALA A  58
THR A 106
THR A 130
 FMT  A 501 (-3.4A)
None
None
None
 0.87A 1gtfN-4kv7A:
undetectable
1gtfO-4kv7A:
undetectable		 1gtfN-4kv7A:
13.40
1gtfO-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GTN_L_TRPL81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 9 GLY A 127
ALA A  58
THR A 106
THR A 130
SER A  56
 FMT  A 501 (-3.4A)
None
None
None
None
 1.32A 1gtnL-4kv7A:
undetectable
1gtnM-4kv7A:
undetectable		 1gtnL-4kv7A:
13.40
1gtnM-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GTN_Q_TRPQ81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 9 GLY A 127
ALA A  58
THR A 106
THR A 130
SER A  56
 FMT  A 501 (-3.4A)
None
None
None
None
 1.33A 1gtnQ-4kv7A:
undetectable
1gtnR-4kv7A:
undetectable		 1gtnQ-4kv7A:
13.40
1gtnR-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HK2_A_T44A3004_1
(SERUM ALBUMIN)		 2dby GTP-BINDING PROTEIN
(Thermus
thermophilus) 		4 / 7 PHE A 287
ALA A 309
GLU A 312
VAL A 364
 None
None
None
FMT  A 402 (-3.7A)
 0.91A 1hk2A-2dbyA:
undetectable		 1hk2A-2dbyA:
21.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HO5_A_ADNA1604_1
(5'-NUCLEOTIDASE)		 3c9f 5'-NUCLEOTIDASE
(Candida
albicans) 		5 / 11 GLY A 388
ARG A 391
PHE A 410
ASN A 412
PHE A 521
 None
FMT  A 607 (-2.7A)
None
None
None
 0.98A 1ho5A-3c9fA:
25.6		 1ho5A-3c9fA:
22.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HO5_B_ADNB2604_1
(5'-NUCLEOTIDASE)		 3c9f 5'-NUCLEOTIDASE
(Candida
albicans) 		5 / 10 GLY A 388
ARG A 391
PHE A 410
ASN A 412
PHE A 521
 None
FMT  A 607 (-2.7A)
None
None
None
 0.85A 1ho5B-3c9fA:
25.3		 1ho5B-3c9fA:
22.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HSG_B_MK1B902_1
(HIV-1 PROTEASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 10 ALA A 134
VAL A 259
ILE A 309
GLY A 305
ILE A 261
 None
FMT  A 465 ( 4.3A)
FMT  A 465 (-4.9A)
None
None
 0.98A 1hsgA-3oksA:
undetectable		 1hsgA-3oksA:
13.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1I7Z_A_COCA301_1
(CHIMERA OF IG KAPPA
CHAIN: HUMAN
CONSTANT REGION AND
MOUSE VARIABLE
REGION)		 2dby GTP-BINDING PROTEIN
(Thermus
thermophilus) 		4 / 8 HIS A 105
TYR A 206
LEU A   9
GLU A 134
 FMT  A 401 (-4.0A)
None
None
None
 0.84A 1i7zA-2dbyA:
undetectable		 1i7zA-2dbyA:
21.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ISM_B_NCAB305_0
(BONE MARROW STROMAL
CELL ANTIGEN 1)		 3slz GAG-PRO-POL
POLYPROTEIN
(Murine
leukemia
virus) 		4 / 7 HIS A  80
LEU A  83
SER A  38
ASP A  96
 FMT  A 127 (-3.4A)
None
None
None
 1.10A 1ismB-3slzA:
undetectable		 1ismB-3slzA:
19.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1JG4_A_SAMA500_1
(PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE)		 3gjy SPERMIDINE SYNTHASE
(Corynebacterium
glutamicum) 		4 / 8 GLY A  94
GLU A 117
LEU A 122
ASP A 144
 None
FMT  A 315 (-3.6A)
FMT  A 315 (-4.0A)
None
 0.61A 1jg4A-3gjyA:
8.8		 1jg4A-3gjyA:
22.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1JTX_A_CVIA200_0
(HYPOTHETICAL
TRANSCRIPTIONAL
REGULATOR IN QACA
5'REGION)		 3c7o ENDO-1,4-BETA-XYLANA
SE
(Bacillus
subtilis) 		5 / 12 THR A   5
ILE A  17
ALA A 344
ASN A 342
THR A 308
 None
None
FMT  A2065 (-3.3A)
FMT  A2065 (-4.0A)
None
 1.10A 1jtxA-3c7oA:
undetectable		 1jtxA-3c7oA:
16.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1K6C_B_MK1B902_2
(POL POLYPROTEIN)		 3lp6 PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE
CATALYTIC SUBUNIT
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  71
ALA A  70
ASP A  19
GLY A 122
ILE A 121
 FMT  A 175 (-4.1A)
FMT  A 175 ( 4.3A)
FMT  A 175 (-3.5A)
None
None
 0.96A 1k6cB-3lp6A:
undetectable		 1k6cB-3lp6A:
18.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1K6C_B_MK1B902_2
(POL POLYPROTEIN)		 3opq PHOSPHORIBOSYLAMINOI
MIDAZOLE
CARBOXYLASE,CATALYTI
C SUBUNIT
(Francisella
tularensis) 		5 / 12 GLY A  66
ALA A  65
ASP A  14
GLY A 117
ILE A 116
 PO4  A 164 (-3.7A)
PO4  A 164 (-3.3A)
PO4  A 164 (-2.8A)
FMT  A 166 (-3.3A)
None
 0.99A 1k6cB-3opqA:
undetectable		 1k6cB-3opqA:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1KIA_D_SAMD3293_0
(GLYCINE
N-METHYLTRANSFERASE)		 4pys BETA-N-ACETYLHEXOSAM
INIDASE
(Bacteroides
fragilis) 		5 / 12 GLY A 354
ASP A 303
ALA A 386
LEU A 441
TYR A 402
 FMT  A 607 (-3.0A)
GOL  A 603 (-3.0A)
None
None
GOL  A 603 ( 4.5A)
 1.40A 1kiaD-4pysA:
undetectable		 1kiaD-4pysA:
20.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1KIA_D_SAMD3293_0
(GLYCINE
N-METHYLTRANSFERASE)		 5v12 HERCYNYLCYSTEINE
SULFOXIDE LYASE
(Neurospora
crassa) 		5 / 12 GLY C 199
VAL C 194
ALA C 437
MET C 197
SER C 440
 None
None
None
FMT  C 501 ( 4.9A)
None
 1.32A 1kiaD-5v12C:
undetectable		 1kiaD-5v12C:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1KIA_D_SAMD3293_1
(GLYCINE
N-METHYLTRANSFERASE)		 5u4h UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE
(Acinetobacter
baumannii) 		4 / 5 ILE A 118
ARG A 332
ASP A  49
ASN A  51
 0V5  A 509 (-4.5A)
FMT  A 507 (-3.5A)
None
None
 1.32A 1kiaD-5u4hA:
undetectable		 1kiaD-5u4hA:
22.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1KNY_B_KANB559_1
(KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE)		 3t9p MANDELATE
RACEMASE/MUCONATE
LACTONIZING ENZYME
FAMILY PROTEIN
(Roseovarius
sp.
TM1035) 		4 / 8 GLU A 333
LYS A 167
GLU A 257
GLU A 231
 None
None
FMT  A 391 (-3.6A)
None
 1.15A 1knyA-3t9pA:
undetectable
1knyB-3t9pA:
undetectable		 1knyA-3t9pA:
18.69
1knyB-3t9pA:
18.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1KYV_A_RBFA501_1
(6,7-DIMETHYL-8-RIBIT
YLLUMAZINE SYNTHASE)		 5v0t ALPHA,ALPHA-TREHALOS
E-PHOSPHATE SYNTHASE
(UDP-FORMING)
(Paraburkholderia
xenovorans) 		5 / 12 GLY A 283
GLU A 286
LEU A 278
ILE A 324
HIS A  99
 None
FMT  A 512 (-3.7A)
None
None
None
 1.13A 1kyvA-5v0tA:
4.4
1kyvE-5v0tA:
4.2		 1kyvA-5v0tA:
16.40
1kyvE-5v0tA:
16.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1KYV_C_RBFC503_1
(6,7-DIMETHYL-8-RIBIT
YLLUMAZINE SYNTHASE)		 5v0t ALPHA,ALPHA-TREHALOS
E-PHOSPHATE SYNTHASE
(UDP-FORMING)
(Paraburkholderia
xenovorans) 		5 / 12 HIS A  99
GLY A 283
GLU A 286
LEU A 278
ILE A 324
 None
None
FMT  A 512 (-3.7A)
None
None
 1.13A 1kyvB-5v0tA:
4.3
1kyvC-5v0tA:
4.4		 1kyvB-5v0tA:
16.40
1kyvC-5v0tA:
16.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1KYV_D_RBFD504_1
(6,7-DIMETHYL-8-RIBIT
YLLUMAZINE SYNTHASE)		 5v0t ALPHA,ALPHA-TREHALOS
E-PHOSPHATE SYNTHASE
(UDP-FORMING)
(Paraburkholderia
xenovorans) 		5 / 12 HIS A  99
GLY A 283
GLU A 286
LEU A 278
ILE A 324
 None
None
FMT  A 512 (-3.7A)
None
None
 1.16A 1kyvC-5v0tA:
4.3
1kyvD-5v0tA:
4.4		 1kyvC-5v0tA:
16.40
1kyvD-5v0tA:
16.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1KYV_E_RBFE505_1
(6,7-DIMETHYL-8-RIBIT
YLLUMAZINE SYNTHASE)		 5v0t ALPHA,ALPHA-TREHALOS
E-PHOSPHATE SYNTHASE
(UDP-FORMING)
(Paraburkholderia
xenovorans) 		5 / 12 HIS A  99
GLY A 283
GLU A 286
LEU A 278
ILE A 324
 None
None
FMT  A 512 (-3.7A)
None
None
 1.16A 1kyvD-5v0tA:
4.4
1kyvE-5v0tA:
4.3		 1kyvD-5v0tA:
16.40
1kyvE-5v0tA:
16.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1L5Q_A_CFFA863_1
(GLYCOGEN
PHOSPHORYLASE, LIVER
FORM)		 3ll7 PUTATIVE
METHYLTRANSFERASE
(Porphyromonas
gingivalis) 		4 / 6 PHE A 269
HIS A 295
ALA A 301
GLY A 302
 None
FMT  A 504 ( 4.1A)
None
None
 1.07A 1l5qA-3ll7A:
undetectable		 1l5qA-3ll7A:
19.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1L5Q_B_CFFB1863_1
(GLYCOGEN
PHOSPHORYLASE, LIVER
FORM)		 3ll7 PUTATIVE
METHYLTRANSFERASE
(Porphyromonas
gingivalis) 		4 / 6 PHE A 269
HIS A 295
ALA A 301
GLY A 302
 None
FMT  A 504 ( 4.1A)
None
None
 1.09A 1l5qB-3ll7A:
3.9		 1l5qB-3ll7A:
19.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1L7X_A_CFFA863_1
(GLYCOGEN
PHOSPHORYLASE, LIVER
FORM)		 3ll7 PUTATIVE
METHYLTRANSFERASE
(Porphyromonas
gingivalis) 		4 / 6 PHE A 269
HIS A 295
ALA A 301
GLY A 302
 None
FMT  A 504 ( 4.1A)
None
None
 1.07A 1l7xA-3ll7A:
undetectable		 1l7xA-3ll7A:
19.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1L7X_B_CFFB1863_1
(GLYCOGEN
PHOSPHORYLASE, LIVER
FORM)		 3ll7 PUTATIVE
METHYLTRANSFERASE
(Porphyromonas
gingivalis) 		4 / 6 PHE A 269
HIS A 295
ALA A 301
GLY A 302
 None
FMT  A 504 ( 4.1A)
None
None
 1.11A 1l7xB-3ll7A:
undetectable		 1l7xB-3ll7A:
19.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MJ2_A_SAMA2201_1
(PROTEIN (METHIONINE
REPRESSOR))		 4c6o CAD PROTEIN
(Homo
sapiens) 		4 / 4 HIS A1687
ALA A1688
PHE A1704
GLY A1706
 None
FMT  A2824 ( 3.6A)
None
None
 1.32A 1mj2B-4c6oA:
undetectable		 1mj2B-4c6oA:
13.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MJ2_C_SAMC1200_1
(PROTEIN (METHIONINE
REPRESSOR))		 4c6o CAD PROTEIN
(Homo
sapiens) 		4 / 4 HIS A1687
ALA A1688
PHE A1704
GLY A1706
 None
FMT  A2824 ( 3.6A)
None
None
 1.23A 1mj2D-4c6oA:
undetectable		 1mj2D-4c6oA:
13.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MJ2_C_SAMC2199_0
(PROTEIN (METHIONINE
REPRESSOR))		 5v0t ALPHA,ALPHA-TREHALOS
E-PHOSPHATE SYNTHASE
(UDP-FORMING)
(Paraburkholderia
xenovorans) 		5 / 12 PHE A 363
GLU A 384
ARG A 356
HIS A 442
PRO A 243
 None
UDP  A 501 (-2.8A)
None
None
FMT  A 509 ( 4.6A)
 1.29A 1mj2C-5v0tA:
undetectable
1mj2D-5v0tA:
undetectable		 1mj2C-5v0tA:
11.56
1mj2D-5v0tA:
11.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MJL_A_SAMA200_0
(METHIONINE REPRESSOR
PROTEIN METJ)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		5 / 11 ALA A 188
GLU A 305
ARG A 308
LEU A 309
GLU A 313
 None
None
FMT  A1797 ( 4.4A)
None
None
 1.29A 1mjlA-2c4mA:
undetectable
1mjlB-2c4mA:
undetectable		 1mjlA-2c4mA:
9.53
1mjlB-2c4mA:
9.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MJO_A_SAMA199_1
(METHIONINE REPRESSOR)		 4c6o CAD PROTEIN
(Homo
sapiens) 		4 / 4 HIS A1687
ALA A1688
PHE A1704
GLY A1706
 None
FMT  A2824 ( 3.6A)
None
None
 1.32A 1mjoB-4c6oA:
undetectable		 1mjoB-4c6oA:
13.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MJO_B_SAMB200_0
(METHIONINE REPRESSOR)		 4c6o CAD PROTEIN
(Homo
sapiens) 		4 / 4 HIS A1687
ALA A1688
PHE A1704
GLY A1706
 None
FMT  A2824 ( 3.6A)
None
None
 1.33A 1mjoA-4c6oA:
undetectable		 1mjoA-4c6oA:
13.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MRG_A_ADNA300_1
(ALPHA-MOMORCHARIN)		 1r4p SHIGA-LIKE TOXIN
TYPE II A SUBUNIT
(Escherichia
coli) 		5 / 9 PHE A  92
TYR A 114
ALA A 166
GLU A 167
ARG A 170
 FMT  A3015 ( 4.9A)
FMT  A3015 ( 4.1A)
FMT  A3015 ( 4.9A)
None
None
 0.41A 1mrgA-1r4pA:
23.2		 1mrgA-1r4pA:
23.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MSK_A_SAMA1301_0
(COBALAMIN-DEPENDENT
METHIONINE SYNTHASE)		 5zwp GLUTATHIONE
S-TRANSFERASE 1
(Musca
domestica) 		5 / 10 ASP A 100
ARG A  66
TYR A 113
PRO A 114
TYR A 112
 None
GSH  A 301 (-3.4A)
FMT  A 302 (-4.4A)
None
None
 1.44A 1mskA-5zwpA:
undetectable		 1mskA-5zwpA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MX1_A_THAA1_1
(LIVER
CARBOXYLESTERASE I)		 1u60 PROBABLE GLUTAMINASE
YBAS
(Escherichia
coli) 		5 / 11 LEU A 205
GLY A 265
GLY A 264
LEU A 283
LEU A  64
 None
None
None
FMT  A1212 ( 4.5A)
None
 0.73A 1mx1A-1u60A:
undetectable		 1mx1A-1u60A:
21.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MX1_A_THAA1_1
(LIVER
CARBOXYLESTERASE I)		 3cp7 ALKALINE SERINE
PROTEASE AL20
(Nesterenkonia
aethiopica) 		5 / 11 GLY A 166
GLY A 167
SER A 169
VAL A  12
HIS A  41
 FMT  A 219 (-3.5A)
FMT  A 219 (-3.6A)
FMT  A 219 (-2.6A)
None
FMT  A 219 (-3.9A)
 1.10A 1mx1A-3cp7A:
undetectable		 1mx1A-3cp7A:
16.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MX1_D_THAD4_1
(LIVER
CARBOXYLESTERASE I)		 1u60 PROBABLE GLUTAMINASE
YBAS
(Escherichia
coli) 		5 / 12 LEU A 205
GLY A 265
GLY A 264
LEU A 283
LEU A  64
 None
None
None
FMT  A1212 ( 4.5A)
None
 0.74A 1mx1D-1u60A:
undetectable		 1mx1D-1u60A:
21.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MX1_F_THAF6_1
(LIVER
CARBOXYLESTERASE I)		 3cp7 ALKALINE SERINE
PROTEASE AL20
(Nesterenkonia
aethiopica) 		5 / 12 GLY A 166
GLY A 167
SER A 169
VAL A  12
HIS A  41
 FMT  A 219 (-3.5A)
FMT  A 219 (-3.6A)
FMT  A 219 (-2.6A)
None
FMT  A 219 (-3.9A)
 1.00A 1mx1F-3cp7A:
undetectable		 1mx1F-3cp7A:
16.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MX1_F_THAF6_1
(LIVER
CARBOXYLESTERASE I)		 3nnm CURA
(Lyngbya
majuscula) 		5 / 12 GLY A 130
LEU A  95
MET A  96
PHE A 123
HIS A  99
 None
None
None
None
FMT  A 750 (-4.3A)
 1.07A 1mx1F-3nnmA:
undetectable		 1mx1F-3nnmA:
21.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1N13_B_AG2B7011_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN)		 3r1x 2-OXO-3-DEOXYGALACTO
NATE KINASE
(Klebsiella
pneumoniae) 		4 / 5 ARG A 109
LEU A 146
ASP A 154
LEU A  81
 FMT  A 294 ( 4.6A)
None
FMT  A 294 (-3.4A)
None
 1.23A 1n13B-3r1xA:
undetectable
1n13C-3r1xA:
undetectable		 1n13B-3r1xA:
15.10
1n13C-3r1xA:
12.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1N4H_A_REAA500_1
(NUCLEAR RECEPTOR
ROR-BETA)		 4rzm EPOXIDE HYDROLASE
LASB
(Streptomyces
lasaliensis) 		5 / 11 ALA A  83
ARG A 101
ARG A  99
VAL A  63
LEU A  36
 FMT  A 303 ( 4.3A)
None
None
None
None
 1.12A 1n4hA-4rzmA:
undetectable		 1n4hA-4rzmA:
18.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1NBH_A_SAMA293_0
(GLYCINE
N-METHYLTRANSFERASE)		 5v12 HERCYNYLCYSTEINE
SULFOXIDE LYASE
(Neurospora
crassa) 		5 / 12 GLY C 199
VAL C 194
ALA C 437
MET C 197
SER C 440
 None
None
None
FMT  C 501 ( 4.9A)
None
 1.32A 1nbhA-5v12C:
undetectable		 1nbhA-5v12C:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1NBH_C_SAMC2293_0
(GLYCINE
N-METHYLTRANSFERASE)		 5v12 HERCYNYLCYSTEINE
SULFOXIDE LYASE
(Neurospora
crassa) 		5 / 12 GLY C 199
VAL C 194
ALA C 437
MET C 197
SER C 440
 None
None
None
FMT  C 501 ( 4.9A)
None
 1.31A 1nbhC-5v12C:
undetectable		 1nbhC-5v12C:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1NBH_D_SAMD3293_0
(GLYCINE
N-METHYLTRANSFERASE)		 5gzt CHITINASE
(Paenibacillus
sp.
FPU-7) 		5 / 12 VAL B 850
ALA B 869
SER B 886
SER B 817
HIS B 779
 FMT  B4011 (-4.8A)
None
None
None
None
 1.40A 1nbhD-5gztB:
undetectable		 1nbhD-5gztB:
14.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1NBH_D_SAMD3293_0
(GLYCINE
N-METHYLTRANSFERASE)		 5v12 HERCYNYLCYSTEINE
SULFOXIDE LYASE
(Neurospora
crassa) 		5 / 12 GLY C 199
VAL C 194
ALA C 437
MET C 197
SER C 440
 None
None
None
FMT  C 501 ( 4.9A)
None
 1.31A 1nbhD-5v12C:
undetectable		 1nbhD-5v12C:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1NBI_C_SAMC2293_1
(GLYCINE
N-METHYLTRANSFERASE)		 5u4h UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE
(Acinetobacter
baumannii) 		4 / 4 ILE A 118
ARG A 332
ASP A  49
ASN A  51
 0V5  A 509 (-4.5A)
FMT  A 507 (-3.5A)
None
None
 1.31A 1nbiC-5u4hA:
undetectable		 1nbiC-5u4hA:
21.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1NBI_D_SAMD3293_1
(GLYCINE
N-METHYLTRANSFERASE)		 5u4h UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE
(Acinetobacter
baumannii) 		4 / 4 ILE A 118
ARG A 332
ASP A  49
ASN A  51
 0V5  A 509 (-4.5A)
FMT  A 507 (-3.5A)
None
None
 1.33A 1nbiD-5u4hA:
undetectable		 1nbiD-5u4hA:
21.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1OE1_A_CUA502_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 3c9f 5'-NUCLEOTIDASE
(Candida
albicans) 		3 / 3 ASP A  80
HIS A 115
HIS A  36
 ZN  A 601 ( 2.7A)
FMT  A 607 (-4.0A)
None
 0.61A 1oe1A-3c9fA:
undetectable		 1oe1A-3c9fA:
20.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1OE1_A_CUA502_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 3wia NITRITE REDUCTASE
(Geobacillus
kaustophilus) 		3 / 3 ASP A  98
HIS A 100
HIS A 134
 FMT  A 403 ( 3.4A)
CU  A 402 (-3.2A)
CU  A 402 ( 3.2A)
 0.17A 1oe1A-3wiaA:
30.0		 1oe1A-3wiaA:
29.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1OE3_A_CUA502_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 3c9f 5'-NUCLEOTIDASE
(Candida
albicans) 		3 / 3 ASP A  80
HIS A 115
HIS A  36
 ZN  A 601 ( 2.7A)
FMT  A 607 (-4.0A)
None
 0.60A 1oe3A-3c9fA:
undetectable		 1oe3A-3c9fA:
20.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1OE3_A_CUA502_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 3wia NITRITE REDUCTASE
(Geobacillus
kaustophilus) 		3 / 3 ASP A  98
HIS A 100
HIS A 134
 FMT  A 403 ( 3.4A)
CU  A 402 (-3.2A)
CU  A 402 ( 3.2A)
 0.18A 1oe3A-3wiaA:
30.0		 1oe3A-3wiaA:
29.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1OIP_A_VIVA1278_1
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)		 1r4p SHIGA-LIKE TOXIN
TYPE II A SUBUNIT
(Escherichia
coli) 		4 / 5 SER A 134
SER A 138
VAL A 164
PHE A 161
 FMT  A3013 (-2.6A)
None
None
None
 0.95A 1oipA-1r4pA:
undetectable		 1oipA-1r4pA:
19.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1OLT_A_SAMA501_0
(OXYGEN-INDEPENDENT
COPROPORPHYRINOGEN
III OXIDASE)		 3m49 TRANSKETOLASE
(Bacillus
anthracis) 		5 / 12 THR A 247
GLU A 244
ASP A 185
GLY A 156
PHE A 199
 FMT  A 721 (-4.1A)
None
None
TDP  A 701 ( 3.7A)
None
 1.21A 1oltA-3m49A:
undetectable		 1oltA-3m49A:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ONI_A_BEZA501_0
(14.5 KDA
TRANSLATIONAL
INHIBITOR PROTEIN)		 6e85 -
(-) 		4 / 7 PHE A 251
ALA A 207
TYR A 266
PRO A 247
 FMT  A 402 (-4.8A)
None
None
None
 0.99A 1oniA-6e85A:
undetectable
1oniB-6e85A:
2.5		 1oniA-6e85A:
undetectable
1oniB-6e85A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ONI_I_BEZI517_0
(14.5 KDA
TRANSLATIONAL
INHIBITOR PROTEIN)		 6e85 -
(-) 		4 / 7 TYR A 266
PRO A 247
PHE A 251
ALA A 207
 None
None
FMT  A 402 (-4.8A)
None
 1.05A 1oniG-6e85A:
2.5
1oniI-6e85A:
undetectable		 1oniG-6e85A:
undetectable
1oniI-6e85A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1OPJ_B_STIB4_2
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1)		 3rxy NIF3 PROTEIN
(Sphaerobacter
thermophilus) 		4 / 6 LEU A 102
VAL A 183
ILE A 226
ARG A 219
 FMT  A 279 ( 4.5A)
None
None
None
 1.11A 1opjB-3rxyA:
undetectable		 1opjB-3rxyA:
22.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1PHG_A_MYTA422_1
(CYTOCHROME P450-CAM)		 5t96 HE PROTEIN
(Salmon
isavirus) 		5 / 11 THR A 157
GLY A 135
VAL A 160
ILE A 158
VAL A 159
 None
None
None
FMT  A 406 (-4.2A)
None
 1.22A 1phgA-5t96A:
undetectable		 1phgA-5t96A:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QAB_E_RTLE1_0
(PROTEIN (RETINOL
BINDING PROTEIN))		 5ab8 GROUP 1 TRUNCATED
HEMOGLOBIN GLBN
(Mycobacterium
tuberculosis) 		5 / 11 PHE A  32
LEU A  98
MET A  77
LEU A  66
HIS A  81
 FMT  A1129 ( 4.9A)
None
HEM  A 144 (-3.5A)
None
HEM  A 144 ( 3.2A)
 1.41A 1qabE-5ab8A:
undetectable		 1qabE-5ab8A:
20.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QKN_A_RALA600_2
(ESTROGEN RECEPTOR
BETA)		 3nnm CURA
(Lyngbya
majuscula) 		3 / 3 ASP A 166
LEU A 169
HIS A  99
 None
None
FMT  A 750 (-4.3A)
 0.69A 1qknA-3nnmA:
undetectable		 1qknA-3nnmA:
20.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QZZ_A_SAMA635_0
(ACLACINOMYCIN-10-HYD
ROXYLASE)		 3rpw ABC TRANSPORTER
(Rhodopseudomonas
palustris) 		5 / 12 GLY A  40
GLY A  39
GLY A  38
LEU A  45
PHE A 297
 None
FMT  A 370 (-3.8A)
FMT  A 370 (-3.7A)
None
GOL  A 364 (-4.9A)
 1.18A 1qzzA-3rpwA:
undetectable		 1qzzA-3rpwA:
23.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RJD_A_SAMA801_1
(CARBOXY METHYL
TRANSFERASE FOR
PROTEIN PHOSPHATASE
2A CATALYTIC SUBUNIT)		 3ll7 PUTATIVE
METHYLTRANSFERASE
(Porphyromonas
gingivalis) 		4 / 6 ARG A 171
TYR A 165
ASP A 104
GLU A 185
 None
None
FMT  A 503 (-4.0A)
None
 1.14A 1rjdA-3ll7A:
7.5		 1rjdA-3ll7A:
22.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1S19_A_MC9A500_0
(VITAMIN D3 RECEPTOR)		 3c7o ENDO-1,4-BETA-XYLANA
SE
(Bacillus
subtilis) 		5 / 12 LEU A 204
VAL A 211
ILE A 202
TYR A 119
LEU A 161
 None
FMT  A2057 ( 4.5A)
None
None
None
 1.01A 1s19A-3c7oA:
undetectable		 1s19A-3c7oA:
16.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1SDT_B_MK1B902_2
(PROTEASE RETROPEPSIN)		 3lp6 PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE
CATALYTIC SUBUNIT
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  71
ALA A  70
ASP A  19
GLY A 122
ILE A 121
 FMT  A 175 (-4.1A)
FMT  A 175 ( 4.3A)
FMT  A 175 (-3.5A)
None
None
 0.98A 1sdtB-3lp6A:
undetectable		 1sdtB-3lp6A:
21.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1SQ5_B_PAUB6003_0
(PANTOTHENATE KINASE)		 1u60 PROBABLE GLUTAMINASE
YBAS
(Escherichia
coli) 		5 / 10 LEU A 283
GLY A 263
TYR A 244
LEU A  33
ILE A  67
 FMT  A1212 ( 4.5A)
None
None
None
None
 1.35A 1sq5B-1u60A:
undetectable		 1sq5B-1u60A:
19.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1SQ5_B_PAUB6003_0
(PANTOTHENATE KINASE)		 3s9j MEMBER OF DUF4221
FAMILY
(Bacteroides
vulgatus) 		5 / 10 LEU A 273
GLY A 222
TYR A 209
LEU A 286
TYR A 159
 None
GOL  A 416 ( 3.3A)
None
FMT  A 404 ( 4.9A)
FMT  A 411 (-3.9A)
 1.16A 1sq5B-3s9jA:
undetectable		 1sq5B-3s9jA:
19.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1T7I_A_017A200_1
(POL POLYPROTEIN)		 3lp6 PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE
CATALYTIC SUBUNIT
(Mycobacterium
tuberculosis) 		5 / 10 GLY A  71
ALA A  70
ASP A  19
GLY A 122
ILE A 121
 FMT  A 175 (-4.1A)
FMT  A 175 ( 4.3A)
FMT  A 175 (-3.5A)
None
None
 1.03A 1t7iA-3lp6A:
undetectable		 1t7iA-3lp6A:
18.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1TLM_A_MILA128_1
(TRANSTHYRETIN)		 3lnb N-ACETYLTRANSFERASE
FAMILY PROTEIN
(Bacillus
anthracis) 		3 / 3 LEU A  29
LEU A 132
SER A 144
 None
FMT  A1002 ( 4.6A)
FMT  A1002 (-4.4A)
 0.52A 1tlmA-3lnbA:
undetectable		 1tlmA-3lnbA:
17.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1TUV_A_VK3A4558_1
(PROTEIN YGIN)		 3lag UNCHARACTERIZED
PROTEIN RPA4178
(Rhodopseudomonas
palustris) 		4 / 7 TYR A  38
GLU A  90
HIS A  34
MET A  48
 FMT  A 100 (-4.4A)
FMT  A 100 (-2.9A)
NI  A  98 ( 3.2A)
None
 1.16A 1tuvA-3lagA:
undetectable		 1tuvA-3lagA:
23.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UKB_A_BEZA1301_0
(2-HYDROXY-6-OXO-7-ME
THYLOCTA-2,4-DIENOAT
E HYDROLASE)		 5tp4 AMIDASE,
HYDANTOINASE/CARBAMO
YLASE FAMILY
(Burkholderia
ambifaria) 		4 / 6 LEU A 139
PHE A 134
ALA A 135
LEU A 148
 None
None
FMT  A 511 ( 4.5A)
None
 0.97A 1ukbA-5tp4A:
2.7		 1ukbA-5tp4A:
23.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UTD_M_TRPM81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 11 GLY A 127
ALA A  58
THR A 106
THR A 130
SER A  56
 FMT  A 501 (-3.4A)
None
None
None
None
 1.28A 1utdM-4kv7A:
undetectable
1utdN-4kv7A:
undetectable		 1utdM-4kv7A:
13.40
1utdN-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UTD_R_TRPR81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 10 GLY A 127
ALA A  58
THR A 106
THR A 130
SER A  56
 FMT  A 501 (-3.4A)
None
None
None
None
 1.28A 1utdR-4kv7A:
undetectable
1utdS-4kv7A:
undetectable		 1utdR-4kv7A:
13.40
1utdS-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UW6_A_NCTA1208_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 3pmm PUTATIVE CYTOPLASMIC
PROTEIN
(Klebsiella
pneumoniae) 		4 / 8 TYR A 300
TRP A 234
LEU A 174
MET A 170
 None
None
None
FMT  A 388 (-4.3A)
 1.46A 1uw6A-3pmmA:
undetectable
1uw6B-3pmmA:
undetectable		 1uw6A-3pmmA:
20.56
1uw6B-3pmmA:
20.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UW6_D_NCTD1208_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 3pmm PUTATIVE CYTOPLASMIC
PROTEIN
(Klebsiella
pneumoniae) 		4 / 8 TYR A 300
TRP A 234
LEU A 174
MET A 170
 None
None
None
FMT  A 388 (-4.3A)
 1.44A 1uw6D-3pmmA:
undetectable
1uw6E-3pmmA:
undetectable		 1uw6D-3pmmA:
20.56
1uw6E-3pmmA:
20.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UW6_G_NCTG1206_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 3pmm PUTATIVE CYTOPLASMIC
PROTEIN
(Klebsiella
pneumoniae) 		4 / 8 TYR A 300
TRP A 234
LEU A 174
MET A 170
 None
None
None
FMT  A 388 (-4.3A)
 1.47A 1uw6G-3pmmA:
undetectable
1uw6H-3pmmA:
undetectable		 1uw6G-3pmmA:
20.56
1uw6H-3pmmA:
20.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UW6_P_NCTP1206_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 3pmm PUTATIVE CYTOPLASMIC
PROTEIN
(Klebsiella
pneumoniae) 		4 / 8 TYR A 300
TRP A 234
LEU A 174
MET A 170
 None
None
None
FMT  A 388 (-4.3A)
 1.45A 1uw6P-3pmmA:
undetectable
1uw6Q-3pmmA:
undetectable		 1uw6P-3pmmA:
20.56
1uw6Q-3pmmA:
20.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UW6_T_NCTT1208_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 3pmm PUTATIVE CYTOPLASMIC
PROTEIN
(Klebsiella
pneumoniae) 		4 / 8 TRP A 234
LEU A 174
MET A 170
TYR A 300
 None
None
FMT  A 388 (-4.3A)
None
 1.47A 1uw6P-3pmmA:
undetectable
1uw6T-3pmmA:
undetectable		 1uw6P-3pmmA:
20.56
1uw6T-3pmmA:
20.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UWH_B_BAXB1723_1
(B-RAF PROTO-ONCOGENE
SERINE/THREONINE-PRO
TEIN KINASE)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		6 / 12 ALA A  50
LYS A  52
GLU A  66
LEU A  70
LEU A 142
HIS A 149
 6A7  A 401 (-3.3A)
6A7  A 401 ( 2.9A)
FMT  A 404 ( 4.2A)
None
None
FMT  A 403 (-4.6A)
 0.81A 1uwhB-5idnA:
12.1		 1uwhB-5idnA:
26.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1VHW_A_ADNA252_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 4isa UDP-3-O-[3-HYDROXYMY
RISTOYL]
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Escherichia
coli) 		5 / 11 GLY A 193
VAL A 217
GLU A 234
ILE A 198
HIS A  79
 GVR  A 402 (-3.6A)
None
None
FMT  A 405 ( 3.7A)
ZN  A 401 ( 3.3A)
 1.08A 1vhwA-4isaA:
undetectable
1vhwD-4isaA:
undetectable		 1vhwA-4isaA:
21.47
1vhwD-4isaA:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1VHW_C_ADNC252_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 4isa UDP-3-O-[3-HYDROXYMY
RISTOYL]
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Escherichia
coli) 		5 / 11 GLY A 193
VAL A 217
GLU A 234
ILE A 198
HIS A  79
 GVR  A 402 (-3.6A)
None
None
FMT  A 405 ( 3.7A)
ZN  A 401 ( 3.3A)
 1.07A 1vhwC-4isaA:
undetectable
1vhwE-4isaA:
undetectable		 1vhwC-4isaA:
21.47
1vhwE-4isaA:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1VHW_D_ADND252_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 4isa UDP-3-O-[3-HYDROXYMY
RISTOYL]
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Escherichia
coli) 		5 / 11 HIS A  79
GLY A 193
VAL A 217
GLU A 234
ILE A 198
 ZN  A 401 ( 3.3A)
GVR  A 402 (-3.6A)
None
None
FMT  A 405 ( 3.7A)
 1.06A 1vhwA-4isaA:
undetectable
1vhwD-4isaA:
undetectable		 1vhwA-4isaA:
21.47
1vhwD-4isaA:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1VHW_E_ADNE252_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 4isa UDP-3-O-[3-HYDROXYMY
RISTOYL]
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Escherichia
coli) 		5 / 11 HIS A  79
GLY A 193
VAL A 217
GLU A 234
ILE A 198
 ZN  A 401 ( 3.3A)
GVR  A 402 (-3.6A)
None
None
FMT  A 405 ( 3.7A)
 1.08A 1vhwC-4isaA:
undetectable
1vhwE-4isaA:
undetectable		 1vhwC-4isaA:
21.47
1vhwE-4isaA:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1WG8_A_SAMA3142_0
(PREDICTED
S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE)		 2is8 MOLYBDOPTERIN
BIOSYNTHESIS ENZYME,
MOAB
(Thermus
thermophilus) 		5 / 12 GLY A 130
GLN A  19
ASP A  20
HIS A  23
ARG A 136
 None
None
FMT  A1003 (-3.7A)
None
None
 1.18A 1wg8A-2is8A:
2.8		 1wg8A-2is8A:
24.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1WOP_A_FFOA2887_1
(AMINOMETHYLTRANSFERA
SE)		 3o5a PERIPLASMIC NITRATE
REDUCTASE
(Cupriavidus
necator) 		3 / 3 ASP A 617
GLU A 415
ARG A 400
 None
None
FMT  A 803 (-4.0A)
 0.88A 1wopA-3o5aA:
undetectable		 1wopA-3o5aA:
18.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1XVA_A_SAMA293_0
(GLYCINE
N-METHYLTRANSFERASE)		 3vdg PROBABLE GLUCARATE
DEHYDRATASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 VAL A  27
ASP A 405
HIS A 321
ARG A 112
GLY A  95
 None
None
FMT  A 501 (-4.0A)
None
None
 0.95A 1xvaA-3vdgA:
undetectable		 1xvaA-3vdgA:
24.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1XVA_A_SAMA293_0
(GLYCINE
N-METHYLTRANSFERASE)		 3vdg PROBABLE GLUCARATE
DEHYDRATASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 VAL A  27
ASP A 405
HIS A 321
GLY A  95
TYR A 297
 None
None
FMT  A 501 (-4.0A)
None
None
 1.19A 1xvaA-3vdgA:
undetectable		 1xvaA-3vdgA:
24.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1Y7I_A_SALA501_1
(SALICYLIC
ACID-BINDING PROTEIN
2)		 3ed5 YFNB
(Bacillus
subtilis) 		5 / 9 GLY A  84
SER A  72
LEU A  87
TYR A  45
LEU A  29
 None
None
None
FMT  A 239 (-4.7A)
None
 1.21A 1y7iA-3ed5A:
3.5		 1y7iA-3ed5A:
22.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1YAJ_G_BEZG3385_0
(CES1 PROTEIN)		 1yle ARGININE
N-SUCCINYLTRANSFERAS
E, ALPHA CHAIN
(Pseudomonas
aeruginosa) 		3 / 3 SER A 142
VAL A 162
LEU A 123
 FMT  A 601 ( 4.1A)
None
FMT  A 601 (-4.4A)
 0.72A 1yajG-1yleA:
undetectable		 1yajG-1yleA:
20.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1YAT_A_FK5A108_1
(FK506 BINDING
PROTEIN)		 4lmw GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		5 / 11 ARG A 104
PHE A 106
ILE A  91
LEU A  37
ILE A   6
 None
None
None
FMT  A 308 ( 4.4A)
FMT  A 308 ( 4.7A)
 1.13A 1yatA-4lmwA:
undetectable		 1yatA-4lmwA:
16.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1YVP_A_ACTA2001_0
(60-KDA SS-A/RO
RIBONUCLEOPROTEIN)		 6b3p AMY13K
([Eubacterium]
rectale) 		4 / 5 SER A 362
SER A 364
THR A 182
ASN A 184
 None
FMT  A 422 (-3.2A)
None
None
 1.12A 1yvpA-6b3pA:
undetectable		 1yvpA-6b3pA:
13.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1YVP_B_ACTB2002_0
(60-KDA SS-A/RO
RIBONUCLEOPROTEIN)		 6b3p AMY13K
([Eubacterium]
rectale) 		4 / 6 SER A 362
SER A 364
THR A 182
ASN A 184
 None
FMT  A 422 (-3.2A)
None
None
 1.09A 1yvpB-6b3pA:
undetectable		 1yvpB-6b3pA:
13.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2AVD_B_SAMB601_1
(CATECHOL-O-METHYLTRA
NSFERASE)		 5hjr NEUTRAL
ALPHA-GLUCOSIDASE AB
(Mus
musculus) 		3 / 3 SER A 265
GLU A 250
ASP A  42
 None
FMT  A1017 (-4.2A)
None
 0.88A 2avdB-5hjrA:
undetectable		 2avdB-5hjrA:
14.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2B25_B_SAMB602_0
(HYPOTHETICAL PROTEIN)		 5kob PEPTIDE DEFORMYLASE
(Paraburkholderia
xenovorans) 		5 / 12 THR A 164
GLY A  98
GLY A 104
VAL A 138
ARG A 137
 None
FMT  A 202 ( 4.3A)
None
FMT  A 202 ( 3.9A)
None
 1.16A 2b25B-5kobA:
undetectable		 2b25B-5kobA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2B25_B_SAMB602_1
(HYPOTHETICAL PROTEIN)		 3gjy SPERMIDINE SYNTHASE
(Corynebacterium
glutamicum) 		3 / 3 GLY A  94
GLU A 117
ASP A 163
 None
FMT  A 315 (-3.6A)
None
 0.35A 2b25B-3gjyA:
11.0		 2b25B-3gjyA:
25.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2B60_B_RITB100_2
(GAG-POL POLYPROTEIN)		 3lp6 PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE
CATALYTIC SUBUNIT
(Mycobacterium
tuberculosis) 		5 / 11 GLY A  71
ALA A  70
ASP A  19
GLY A 122
ILE A 121
 FMT  A 175 (-4.1A)
FMT  A 175 ( 4.3A)
FMT  A 175 (-3.5A)
None
None
 1.03A 2b60B-3lp6A:
undetectable		 2b60B-3lp6A:
17.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2B7Z_B_MK1B200_1
(HIV-1 PROTEASE)		 3lp6 PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE
CATALYTIC SUBUNIT
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  71
ALA A  70
ASP A  19
GLY A 122
ILE A 121
 FMT  A 175 (-4.1A)
FMT  A 175 ( 4.3A)
FMT  A 175 (-3.5A)
None
None
 0.99A 2b7zA-3lp6A:
undetectable		 2b7zA-3lp6A:
18.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2B7Z_B_MK1B200_1
(HIV-1 PROTEASE)		 3opq PHOSPHORIBOSYLAMINOI
MIDAZOLE
CARBOXYLASE,CATALYTI
C SUBUNIT
(Francisella
tularensis) 		5 / 12 GLY A  66
ALA A  65
ASP A  14
GLY A 117
ILE A 116
 PO4  A 164 (-3.7A)
PO4  A 164 (-3.3A)
PO4  A 164 (-2.8A)
FMT  A 166 (-3.3A)
None
 1.03A 2b7zA-3opqA:
undetectable		 2b7zA-3opqA:
21.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2B7Z_B_MK1B200_2
(HIV-1 PROTEASE)		 3lp6 PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE
CATALYTIC SUBUNIT
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  71
ALA A  70
ASP A  19
GLY A 122
ILE A 121
 FMT  A 175 (-4.1A)
FMT  A 175 ( 4.3A)
FMT  A 175 (-3.5A)
None
None
 0.97A 2b7zB-3lp6A:
undetectable		 2b7zB-3lp6A:
18.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2B7Z_B_MK1B200_2
(HIV-1 PROTEASE)		 3opq PHOSPHORIBOSYLAMINOI
MIDAZOLE
CARBOXYLASE,CATALYTI
C SUBUNIT
(Francisella
tularensis) 		5 / 12 GLY A  66
ALA A  65
ASP A  14
GLY A 117
ILE A 116
 PO4  A 164 (-3.7A)
PO4  A 164 (-3.3A)
PO4  A 164 (-2.8A)
FMT  A 166 (-3.3A)
None
 1.00A 2b7zB-3opqA:
undetectable		 2b7zB-3opqA:
21.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2BR4_A_SAMA301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 3ju1 ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN
(Shewanella
oneidensis) 		5 / 12 LEU A 343
GLY A  82
CYH A  79
ASP A  83
ALA A  43
 None
FMT  A 403 ( 4.3A)
None
None
None
 1.11A 2br4A-3ju1A:
undetectable		 2br4A-3ju1A:
20.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2BR4_B_SAMB301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 3ejn SUSD HOMOLOG
(Bacteroides
fragilis) 		5 / 12 GLU A  93
GLY A  92
ASN A  87
ALA A  95
ALA A 100
 None
None
FMT  A   5 ( 3.9A)
None
None
 0.99A 2br4B-3ejnA:
undetectable		 2br4B-3ejnA:
20.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2BUE_A_RIOA1201_0
(AAC(6')-IB)		 4qc6 BIFUNCTIONAL AAC/APH
(Staphylococcus
warneri) 		6 / 11 GLY A  35
TYR A  50
GLN A  74
TYR A  76
ASP A  99
ASP A 136
 FMT  A 203 ( 3.5A)
KAN  A 201 ( 3.9A)
KAN  A 201 (-3.1A)
None
KAN  A 201 ( 3.9A)
KAN  A 201 (-3.8A)
 0.91A 2bueA-4qc6A:
20.0		 2bueA-4qc6A:
28.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2BXM_A_IMNA2002_1
(SERUM ALBUMIN)		 1vp4 AMINOTRANSFERASE,
PUTATIVE
(Thermotoga
maritima) 		5 / 11 LEU A 201
ILE A 231
PHE A 232
ARG A 239
GLY A 236
 None
None
FMT  A 609 ( 4.9A)
None
FMT  A 609 ( 4.7A)
 1.00A 2bxmA-1vp4A:
undetectable		 2bxmA-1vp4A:
21.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2BXM_A_IMNA2002_1
(SERUM ALBUMIN)		 6fsa -
(-) 		5 / 11 ILE A 285
PHE A 436
TYR A 432
ARG A 272
GLY A 231
 None
None
None
FMT  A2004 (-3.8A)
None
 1.20A 2bxmA-6fsaA:
3.1		 2bxmA-6fsaA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2BXQ_A_IMNA2003_1
(SERUM ALBUMIN)		 6fsa -
(-) 		5 / 10 ILE A 285
PHE A 436
TYR A 432
ARG A 272
GLY A 231
 None
None
None
FMT  A2004 (-3.8A)
None
 1.26A 2bxqA-6fsaA:
2.8		 2bxqA-6fsaA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2CDQ_B_SAMB1500_0
(ASPARTOKINASE)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		4 / 7 SER A 268
ARG A 308
LEU A 309
GLU A 313
 None
FMT  A1797 ( 4.4A)
None
None
 1.03A 2cdqB-2c4mA:
3.4		 2cdqB-2c4mA:
22.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2CIZ_A_ACTA1320_0
(CHLOROPEROXIDASE)		 3fdx PUTATIVE FILAMENT
PROTEIN / UNIVERSAL
STRESS PROTEIN F
(Klebsiella
pneumoniae) 		4 / 6 ALA A  73
ILE A  18
VAL A  21
GLU A  22
 FMT  A 402 ( 4.1A)
None
None
None
 0.77A 2cizA-3fdxA:
undetectable		 2cizA-3fdxA:
18.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2CML_A_ZMRA1478_1
(NEURAMINIDASE)		 4r40 PROTEIN TOLB
(Yersinia
pestis) 		4 / 7 SER A 288
SER A 306
ASN A 269
GLN A 282
 FMT  A 502 (-3.3A)
None
None
None
 1.12A 2cmlA-4r40A:
7.6		 2cmlA-4r40A:
23.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2CML_B_ZMRB2478_1
(NEURAMINIDASE)		 4r40 PROTEIN TOLB
(Yersinia
pestis) 		4 / 8 SER A 288
SER A 306
ASN A 269
GLN A 282
 FMT  A 502 (-3.3A)
None
None
None
 1.08A 2cmlB-4r40A:
7.1		 2cmlB-4r40A:
23.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2COJ_A_GBNA420_1
(BRANCHED CHAIN
AMINOTRANSFERASE 1,
CYTOSOLIC)		 3w2x EXODEOXYRIBONUCLEASE
(Methanothermobac
ter
thermautotrophic
us) 		5 / 11 PHE A 128
TYR A  68
GLY A  70
ALA A  63
TYR A 124
 None
None
None
FMT  A 302 (-4.0A)
None
 1.42A 2cojA-3w2xA:
undetectable
2cojB-3w2xA:
undetectable		 2cojA-3w2xA:
22.28
2cojB-3w2xA:
22.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2DCF_A_ACAA502_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)		 3fg9 PROTEIN OF UNIVERSAL
STRESS PROTEIN USPA
FAMILY
(Lactobacillus
plantarum) 		5 / 12 TYR A  81
VAL A  19
ASP A  20
SER A  27
ASN A  24
 None
None
FMT  A 155 ( 4.9A)
None
FMT  A 155 (-4.4A)
 1.39A 2dcfA-3fg9A:
undetectable		 2dcfA-3fg9A:
17.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2DM6_A_IMNA1401_1
(NADP-DEPENDENT
LEUKOTRIENE B4
12-HYDROXYDEHYDROGEN
ASE)		 3m49 TRANSKETOLASE
(Bacillus
anthracis) 		5 / 10 ILE A   5
ILE A  13
GLU A   6
ILE A  10
TYR A  40
 FMT  A 718 ( 4.3A)
None
None
None
None
 1.16A 2dm6A-3m49A:
2.7
2dm6B-3m49A:
2.8		 2dm6A-3m49A:
19.49
2dm6B-3m49A:
19.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2DU8_A_BEZA352_0
(D-AMINO-ACID OXIDASE)		 5jnf LINEAR GRAMICIDIN
SYNTHASE SUBUNIT A
(Brevibacillus
parabrevis) 		4 / 6 LEU C 400
TYR C 439
ILE C 460
GLY C 482
 None
FMT  C 604 (-4.9A)
None
None
 0.93A 2du8A-5jnfC:
undetectable		 2du8A-5jnfC:
21.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2DU8_B_BEZB1352_0
(D-AMINO-ACID OXIDASE)		 5jnf LINEAR GRAMICIDIN
SYNTHASE SUBUNIT A
(Brevibacillus
parabrevis) 		4 / 6 LEU C 400
TYR C 439
ILE C 460
GLY C 482
 None
FMT  C 604 (-4.9A)
None
None
 0.90A 2du8B-5jnfC:
3.7		 2du8B-5jnfC:
21.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2EUF_B_LQQB401_1
(CELL DIVISION
PROTEIN KINASE 6)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		7 / 12 LYS A  52
PHE A  97
ASP A 103
ASN A 156
LEU A 158
ALA A 172
ASP A 173
 6A7  A 401 ( 2.9A)
6A7  A 401 (-3.8A)
6A7  A 401 ( 4.9A)
FMT  A 403 ( 4.7A)
6A7  A 401 (-4.8A)
6A7  A 401 ( 4.1A)
FMT  A 403 ( 3.3A)
 1.00A 2eufB-5idnA:
22.1		 2eufB-5idnA:
33.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2EUF_B_LQQB401_1
(CELL DIVISION
PROTEIN KINASE 6)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		7 / 12 VAL A  35
LYS A  52
PHE A  97
ASP A 103
LEU A 158
ALA A 172
ASP A 173
 6A7  A 401 ( 4.5A)
6A7  A 401 ( 2.9A)
6A7  A 401 (-3.8A)
6A7  A 401 ( 4.9A)
6A7  A 401 (-4.8A)
6A7  A 401 ( 4.1A)
FMT  A 403 ( 3.3A)
 0.85A 2eufB-5idnA:
22.1		 2eufB-5idnA:
33.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2F7F_A_NIOA601_1
(NICOTINATE
PHOSPHORIBOSYLTRANSF
ERASE, PUTATIVE)		 3os4 NICOTINATE
PHOSPHORIBOSYLTRANSF
ERASE
(Yersinia
pestis) 		4 / 6 PHE A 174
SER A 203
GLY A 217
THR A 218
 None
None
GOL  A 411 (-3.3A)
FMT  A 414 (-2.8A)
 1.02A 2f7fA-3os4A:
6.9		 2f7fA-3os4A:
24.29
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2F7F_A_NIOA601_1
(NICOTINATE
PHOSPHORIBOSYLTRANSF
ERASE, PUTATIVE)		 4mzy NICOTINATE
PHOSPHORIBOSYLTRANSF
ERASE
(Enterococcus
faecalis) 		4 / 6 ARG A 163
SER A 187
GLY A 201
ARG A 262
 CL  A 518 (-4.1A)
None
CL  A 521 (-3.8A)
FMT  A 520 (-3.1A)
 0.65A 2f7fA-4mzyA:
59.0		 2f7fA-4mzyA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2F8L_A_SAMA400_0
(HYPOTHETICAL PROTEIN
LMO1582)		 3vdg PROBABLE GLUCARATE
DEHYDRATASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ASN A 323
ASP A 404
GLY A 399
ASP A  20
PRO A  32
 FMT  A 501 (-4.0A)
None
None
None
None
 1.12A 2f8lA-3vdgA:
undetectable		 2f8lA-3vdgA:
20.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2FJ1_A_CTCA222_0
(TETRACYCLINE
REPRESSOR PROTEIN
CLASS D)		 5odo ISOMERASE
(Rhodococcus
erythropolis) 		5 / 12 HIS A 401
HIS A 399
ARG A  76
ILE A 233
SER A 225
 None
None
FMT  A 607 (-3.6A)
None
None
 1.16A 2fj1A-5odoA:
undetectable		 2fj1A-5odoA:
17.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2FQY_A_ADNA400_1
(MEMBRANE LIPOPROTEIN
TMPC)		 1r4p SHIGA-LIKE TOXIN
TYPE II A SUBUNIT
(Escherichia
coli) 		5 / 12 ASP A  94
MET A 150
PHE A 145
PHE A  92
GLY A  80
 None
None
None
FMT  A3015 ( 4.9A)
None
 1.44A 2fqyA-1r4pA:
undetectable		 2fqyA-1r4pA:
23.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HA4_A_ACTA544_0
(ACETYLCHOLINESTERASE)		 3rpw ABC TRANSPORTER
(Rhodopseudomonas
palustris) 		5 / 8 GLY A  38
GLY A  39
ALA A 219
ALA A 220
PHE A 297
 FMT  A 370 (-3.7A)
FMT  A 370 (-3.8A)
GOL  A 364 (-3.4A)
FMT  A 370 (-3.3A)
GOL  A 364 (-4.9A)
 1.00A 2ha4A-3rpwA:
undetectable		 2ha4A-3rpwA:
20.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HC4_A_VDXA525_1
(VITAMIN D RECEPTOR)		 5vkt CINNAMYL ALCOHOL
DEHYDROGENASES
(SBCAD4)
(Sorghum
bicolor) 		5 / 12 TYR A  95
LEU A 194
CYH A  47
HIS A 258
LEU A 263
 FMT  A 404 (-3.4A)
NAP  A 405 (-3.6A)
ZN  A 401 (-2.3A)
None
None
 1.31A 2hc4A-5vktA:
undetectable		 2hc4A-5vktA:
21.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HRC_B_CHDB1603_0
(FERROCHELATASE)		 3kfl METHIONYL-TRNA
SYNTHETASE
(Leishmania
major) 		4 / 5 MET A 500
ARG A 382
LEU A 413
PRO A 507
 None
None
FMT  A 822 (-4.5A)
None
 1.37A 2hrcB-3kflA:
0.0		 2hrcB-3kflA:
19.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2IGT_A_SAMA1001_0
(SAM DEPENDENT
METHYLTRANSFERASE)		 2igt SAM DEPENDENT
METHYLTRANSFERASE
(Agrobacterium
fabrum) 		12 / 12 PHE A 113
PHE A 140
TYR A 142
ALA A 162
SER A 163
ALA A 166
ALA A 191
PRO A 213
GLY A 216
GLY A 218
TRP A 224
TYR A 253
 FMT  A1013 ( 3.5A)
SAM  A1001 (-4.4A)
FMT  A1013 ( 4.7A)
SAM  A1001 (-3.5A)
ACY  A1008 ( 2.6A)
SAM  A1001 ( 3.9A)
SAM  A1001 (-3.6A)
SAM  A1001 (-3.2A)
SAM  A1001 (-3.5A)
SAM  A1001 (-3.7A)
None
SAM  A1001 (-4.7A)
 0.11A 2igtA-2igtA:
55.4		 2igtA-2igtA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2IGT_B_SAMB1002_0
(SAM DEPENDENT
METHYLTRANSFERASE)		 2igt SAM DEPENDENT
METHYLTRANSFERASE
(Agrobacterium
fabrum) 		12 / 12 PHE A 113
PHE A 140
TYR A 142
ALA A 162
SER A 163
ALA A 166
ALA A 191
PRO A 213
GLY A 216
GLY A 218
TRP A 224
TYR A 253
 FMT  A1013 ( 3.5A)
SAM  A1001 (-4.4A)
FMT  A1013 ( 4.7A)
SAM  A1001 (-3.5A)
ACY  A1008 ( 2.6A)
SAM  A1001 ( 3.9A)
SAM  A1001 (-3.6A)
SAM  A1001 (-3.2A)
SAM  A1001 (-3.5A)
SAM  A1001 (-3.7A)
None
SAM  A1001 (-4.7A)
 0.13A 2igtB-2igtA:
52.2		 2igtB-2igtA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2IGT_C_SAMC1003_0
(SAM DEPENDENT
METHYLTRANSFERASE)		 2igt SAM DEPENDENT
METHYLTRANSFERASE
(Agrobacterium
fabrum) 		6 / 12 HIS A 109
PHE A 140
TYR A 142
ALA A 162
ALA A 191
GLY A 218
 FMT  A1013 (-4.1A)
SAM  A1001 (-4.4A)
FMT  A1013 ( 4.7A)
SAM  A1001 (-3.5A)
SAM  A1001 (-3.6A)
SAM  A1001 (-3.7A)
 1.39A 2igtC-2igtA:
51.6		 2igtC-2igtA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2IGT_C_SAMC1003_0
(SAM DEPENDENT
METHYLTRANSFERASE)		 2igt SAM DEPENDENT
METHYLTRANSFERASE
(Agrobacterium
fabrum) 		11 / 12 PHE A 113
PHE A 140
TYR A 142
ALA A 162
SER A 163
ALA A 166
ALA A 191
PRO A 213
GLY A 218
TRP A 224
TYR A 253
 FMT  A1013 ( 3.5A)
SAM  A1001 (-4.4A)
FMT  A1013 ( 4.7A)
SAM  A1001 (-3.5A)
ACY  A1008 ( 2.6A)
SAM  A1001 ( 3.9A)
SAM  A1001 (-3.6A)
SAM  A1001 (-3.2A)
SAM  A1001 (-3.7A)
None
SAM  A1001 (-4.7A)
 0.08A 2igtC-2igtA:
51.6		 2igtC-2igtA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2IVU_A_ZD6A3015_0
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE RECEPTOR RET
PRECURSOR)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		7 / 12 GLY A  28
VAL A  35
GLU A  66
LEU A  95
TYR A  99
ALA A 100
LEU A 158
 6A7  A 401 (-3.6A)
6A7  A 401 ( 4.5A)
FMT  A 404 ( 4.2A)
None
6A7  A 401 (-4.9A)
6A7  A 401 (-3.7A)
6A7  A 401 (-4.8A)
 0.70A 2ivuA-5idnA:
11.4		 2ivuA-5idnA:
26.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2IVU_A_ZD6A3015_0
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE RECEPTOR RET
PRECURSOR)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		7 / 12 VAL A  35
GLU A  66
LEU A  70
LEU A  95
TYR A  99
ALA A 100
LEU A 158
 6A7  A 401 ( 4.5A)
FMT  A 404 ( 4.2A)
None
None
6A7  A 401 (-4.9A)
6A7  A 401 (-3.7A)
6A7  A 401 (-4.8A)
 0.74A 2ivuA-5idnA:
11.4		 2ivuA-5idnA:
26.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2J2P_B_SC2B1294_1
(FICOLIN-2)		 5x8j THYMIDYLATE KINASE
(Thermus
thermophilus) 		5 / 9 GLY A  13
SER A  14
LEU A 130
ASP A  12
GLU A   9
 FMT  A 201 (-3.3A)
FMT  A 201 (-4.9A)
None
None
None
 1.41A 2j2pB-5x8jA:
undetectable
2j2pC-5x8jA:
undetectable		 2j2pB-5x8jA:
16.97
2j2pC-5x8jA:
16.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2J9C_A_ACTA1122_0
(HYPOTHETICAL
NITROGEN REGULATORY
PII-LIKE PROTEIN
MJ0059)		 2vuo IG GAMMA CHAIN C
REGION
(Oryctolagus
cuniculus) 		4 / 7 SER A 378
LYS A 248
SER A 426
VAL A 379
 FMT  A1458 ( 2.6A)
FMT  A1458 (-2.8A)
FMT  A1458 (-2.7A)
GOL  A1454 (-4.5A)
 1.29A 2j9cA-2vuoA:
undetectable
2j9cB-2vuoA:
undetectable
2j9cC-2vuoA:
undetectable		 2j9cA-2vuoA:
22.28
2j9cB-2vuoA:
22.28
2j9cC-2vuoA:
22.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2J9D_A_ACTA1117_0
(HYPOTHETICAL
NITROGEN REGULATORY
PII-LIKE PROTEIN
MJ0059)		 4qav 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2
(Neisseria
meningitidis) 		3 / 3 ASP A 229
ARG A 228
ARG A 222
 None
None
FMT  A 502 (-3.1A)
 0.91A 2j9dA-4qavA:
undetectable
2j9dC-4qavA:
undetectable		 2j9dA-4qavA:
13.83
2j9dC-4qavA:
13.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2JFA_A_RALA600_1
(ESTROGEN RECEPTOR)		 1zel HYPOTHETICAL PROTEIN
RV2827C
(Mycobacterium
tuberculosis) 		5 / 12 THR A 189
ALA A 188
LEU A 234
LEU A 207
LEU A 220
 FMT  A 707 ( 4.6A)
None
None
None
None
 1.11A 2jfaA-1zelA:
undetectable		 2jfaA-1zelA:
22.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2JFA_A_RALA600_1
(ESTROGEN RECEPTOR)		 3o5a DIHEME CYTOCHROME C
NAPB
PERIPLASMIC NITRATE
REDUCTASE
(Cupriavidus
necator) 		5 / 12 THR B  10
LEU A 491
ARG A  76
MET A 465
LEU A 774
 None
FMT  B 139 (-4.5A)
None
None
CL  A 816 (-4.0A)
 1.13A 2jfaA-3o5aB:
undetectable		 2jfaA-3o5aB:
17.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2JJP_A_KLNA413_1
(CYTOCHROME P450
113A1)		 3nnm CURA
(Lyngbya
majuscula) 		5 / 12 HIS A  66
ALA A  67
LEU A 102
ALA A 101
GLN A 229
 None
None
None
FMT  A 750 ( 4.0A)
None
 1.28A 2jjpA-3nnmA:
undetectable		 2jjpA-3nnmA:
20.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2JN3_A_JN3A130_2
(FATTY ACID-BINDING
PROTEIN, LIVER)		 2cjt UNC-13 HOMOLOG A
(Rattus
norvegicus) 		4 / 7 PHE A  49
LEU A  26
LEU A  60
GLU A  46
 FMT  A1139 ( 4.3A)
None
None
None
 1.05A 2jn3A-2cjtA:
undetectable		 2jn3A-2cjtA:
24.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2KAW_A_SUZA91_1
(SEGMENT POLARITY
PROTEIN DISHEVELLED
HOMOLOG DVL-1)		 5eso 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 11 GLY A 276
SER A 230
ILE A 229
LEU A 288
VAL A 307
 FMT  A 603 ( 3.8A)
None
None
None
None
 0.82A 2kawA-5esoA:
undetectable		 2kawA-5esoA:
10.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2KCE_A_D16A566_2
(THYMIDYLATE SYNTHASE)		 2fsr ACETYLTRANSFERASE
(Agrobacterium
fabrum) 		3 / 3 HIS A 101
ILE A  68
LEU A  96
 FMT  A 301 (-3.9A)
None
None
 0.71A 2kceA-2fsrA:
undetectable		 2kceA-2fsrA:
21.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2KOT_B_ANWB99_0
(PROTEIN S100-A13)		 3pmm PUTATIVE CYTOPLASMIC
PROTEIN
(Klebsiella
pneumoniae) 		4 / 8 MET A 366
ALA A 365
VAL A  31
THR A  32
 None
None
None
FMT  A 387 ( 4.5A)
 1.27A 2kotB-3pmmA:
undetectable		 2kotB-3pmmA:
13.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2O7O_A_DXTA222_1
(TETRACYCLINE
REPRESSOR PROTEIN
CLASS D)		 5odo ISOMERASE
(Rhodococcus
erythropolis) 		5 / 12 HIS A 401
HIS A 399
ARG A  76
ILE A 233
SER A 225
 None
None
FMT  A 607 (-3.6A)
None
None
 1.26A 2o7oA-5odoA:
undetectable		 2o7oA-5odoA:
17.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OBV_A_SAMA501_0
(S-ADENOSYLMETHIONINE
SYNTHETASE ISOFORM
TYPE-1)		 2qfq 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Escherichia
coli) 		4 / 8 HIS A 385
LYS A 411
SER A  25
ASP A 313
 FMT  A 601 (-4.3A)
FMT  A 602 (-2.8A)
None
S3P  A 701 ( 2.8A)
 1.07A 2obvA-2qfqA:
undetectable		 2obvA-2qfqA:
23.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OUZ_A_C3DA999_1
(ESTROGEN RECEPTOR)		 5hjr NEUTRAL
ALPHA-GLUCOSIDASE AB
(Mus
musculus) 		4 / 6 ALA A 773
ASP A 772
TRP A 798
ARG A 834
 None
None
None
FMT  A1022 (-3.6A)
 1.45A 2ouzA-5hjrA:
undetectable		 2ouzA-5hjrA:
15.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2P02_A_SAMA2_0
(S-ADENOSYLMETHIONINE
SYNTHETASE ISOFORM
TYPE-2)		 2qfq 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Escherichia
coli) 		4 / 8 HIS A 385
LYS A 411
SER A  25
ASP A 313
 FMT  A 601 (-4.3A)
FMT  A 602 (-2.8A)
None
S3P  A 701 ( 2.8A)
 1.12A 2p02A-2qfqA:
undetectable		 2p02A-2qfqA:
23.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2PIW_A_T3A933_1
(ANDROGEN RECEPTOR)		 1vp4 AMINOTRANSFERASE,
PUTATIVE
(Thermotoga
maritima) 		5 / 10 ILE A 212
PHE A 211
GLY A 261
ASN A  99
GLU A 264
 None
None
FMT  A 622 (-3.5A)
None
None
 1.27A 2piwA-1vp4A:
undetectable		 2piwA-1vp4A:
17.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Q2H_B_ACTB501_0
(SECRETION CHAPERONE,
PHAGE-DISPLAY
DERIVED PEPTIDE)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		3 / 3 ARG A 231
SER A 200
TYR A 101
 None
None
FMT  A 501 (-4.6A)
 0.84A 2q2hA-4kv7A:
undetectable
2q2hB-4kv7A:
undetectable		 2q2hA-4kv7A:
16.62
2q2hB-4kv7A:
16.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Q63_A_1UNA1001_4
(PROTEASE RETROPEPSIN)		 2qfq 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Escherichia
coli) 		3 / 3 ASP A  49
ASN A  26
THR A 174
 FMT  A 602 ( 4.6A)
None
S3P  A 701 ( 4.8A)
 0.69A 2q63B-2qfqA:
undetectable		 2q63B-2qfqA:
14.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QEU_A_ACTA141_0
(PUTATIVE
CARBOXYMUCONOLACTONE
DECARBOXYLASE)		 1kgd PERIPHERAL PLASMA
MEMBRANE CASK
(Homo
sapiens) 		3 / 3 VAL A 832
ASP A 831
GLU A 802
 None
None
FMT  A 601 ( 4.4A)
 0.62A 2qeuA-1kgdA:
undetectable		 2qeuA-1kgdA:
23.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QEU_C_ACTC141_0
(PUTATIVE
CARBOXYMUCONOLACTONE
DECARBOXYLASE)		 1kgd PERIPHERAL PLASMA
MEMBRANE CASK
(Homo
sapiens) 		3 / 3 VAL A 832
ASP A 831
GLU A 802
 None
None
FMT  A 601 ( 4.4A)
 0.63A 2qeuC-1kgdA:
0.0		 2qeuC-1kgdA:
23.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QHC_B_AB1B9001_2
(PROTEASE RETROPEPSIN)		 3lp6 PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE
CATALYTIC SUBUNIT
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  71
ALA A  70
ASP A  19
GLY A 122
ILE A 121
 FMT  A 175 (-4.1A)
FMT  A 175 ( 4.3A)
FMT  A 175 (-3.5A)
None
None
 1.00A 2qhcB-3lp6A:
undetectable		 2qhcB-3lp6A:
20.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QL8_B_BEZB143_0
(PUTATIVE REDOX
PROTEIN)		 3kbr CYCLOHEXADIENYL
DEHYDRATASE
(Pseudomonas
aeruginosa) 		4 / 6 ARG A 200
THR A 126
ALA A 199
PRO A 214
 None
None
None
FMT  A 265 (-4.1A)
 1.38A 2ql8A-3kbrA:
undetectable
2ql8B-3kbrA:
undetectable		 2ql8A-3kbrA:
20.50
2ql8B-3kbrA:
20.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QX6_A_ML1A233_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 1vp4 AMINOTRANSFERASE,
PUTATIVE
(Thermotoga
maritima) 		4 / 6 ILE A  21
PHE A 370
GLY A  38
GLY A  37
 EDO  A 604 (-4.4A)
None
EDO  A 604 ( 3.1A)
FMT  A 607 (-4.6A)
 0.83A 2qx6A-1vp4A:
2.9
2qx6B-1vp4A:
2.9		 2qx6A-1vp4A:
19.91
2qx6B-1vp4A:
19.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QX6_A_ML1A233_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 4lgn CELLULOSE-BINDING,
FAMILY II
(Acidothermus
cellulolyticus) 		4 / 6 ILE A 141
PHE A 196
GLY A 228
GLY A 227
 None
None
FMT  A 834 (-3.9A)
None
 0.80A 2qx6A-4lgnA:
undetectable
2qx6B-4lgnA:
undetectable		 2qx6A-4lgnA:
15.11
2qx6B-4lgnA:
15.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QXS_B_RALB600_1
(ESTROGEN RECEPTOR)		 1zel HYPOTHETICAL PROTEIN
RV2827C
(Mycobacterium
tuberculosis) 		5 / 12 THR A 189
ALA A 188
LEU A 234
LEU A 207
LEU A 220
 FMT  A 707 ( 4.6A)
None
None
None
None
 1.15A 2qxsB-1zelA:
undetectable		 2qxsB-1zelA:
23.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2TRT_A_TACA222_1
(TETRACYCLINE
REPRESSOR CLASS D)		 5odo ISOMERASE
(Rhodococcus
erythropolis) 		5 / 11 HIS A 401
HIS A 399
ARG A  76
ILE A 233
SER A 225
 None
None
FMT  A 607 (-3.6A)
None
None
 1.28A 2trtA-5odoA:
undetectable		 2trtA-5odoA:
17.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2V0M_D_KLND1499_1
(CYTOCHROME P450 3A4)		 3s9j MEMBER OF DUF4221
FAMILY
(Bacteroides
vulgatus) 		4 / 5 PHE A 107
PHE A  57
SER A 112
ILE A 165
 None
None
FMT  A 408 (-4.3A)
FMT  A 408 ( 4.1A)
 1.37A 2v0mD-3s9jA:
undetectable		 2v0mD-3s9jA:
23.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2V0Z_O_C41O1327_2
(RENIN)		 4az1 TYROSINE SPECIFIC
PROTEIN PHOSPHATASE
(Trypanosoma
cruzi) 		4 / 8 SER A 205
TYR A 191
LEU A 122
THR A 211
 None
None
FMT  A1305 (-3.7A)
None
 1.10A 2v0zO-4az1A:
undetectable		 2v0zO-4az1A:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VCV_L_ASDL1224_1
(GLUTATHIONE
S-TRANSFERASE A3)		 4o6q HASAP
(Pseudomonas
aeruginosa) 		4 / 7 LEU A  85
ALA A  75
PHE A  51
PHE A  46
 HEM  A 202 (-3.7A)
FMT  A 201 (-3.6A)
HEM  A 202 ( 4.9A)
None
 0.86A 2vcvL-4o6qA:
undetectable		 2vcvL-4o6qA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VE3_B_REAB1445_1
(PUTATIVE CYTOCHROME
P450 120)		 1xfp HEAVY CHAIN ANTIBODY
(Camelus
dromedarius) 		5 / 12 ALA A   6
ALA A  97
VAL A   2
GLY A  26
PRO A  31
 FMT  A 403 (-3.5A)
None
None
None
None
 1.22A 2ve3B-1xfpA:
undetectable		 2ve3B-1xfpA:
14.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VKE_A_TACA222_1
(TETRACYCLINE
REPRESSOR PROTEIN
CLASS D)		 5odo ISOMERASE
(Rhodococcus
erythropolis) 		5 / 11 HIS A 401
HIS A 399
ARG A  76
ILE A 233
SER A 225
 None
None
FMT  A 607 (-3.6A)
None
None
 1.22A 2vkeA-5odoA:
0.0		 2vkeA-5odoA:
17.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VMY_A_GLYA502_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 3c9f 5'-NUCLEOTIDASE
(Candida
albicans) 		4 / 7 HIS A 249
HIS A  36
ARG A 391
TYR A 118
 ZN  A 601 ( 3.4A)
None
FMT  A 607 (-2.7A)
None
 1.44A 2vmyA-3c9fA:
undetectable
2vmyB-3c9fA:
undetectable		 2vmyA-3c9fA:
19.21
2vmyB-3c9fA:
19.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VQY_A_PARA1201_1
(AAC(6')-IB)		 4qc6 BIFUNCTIONAL AAC/APH
(Staphylococcus
warneri) 		6 / 12 GLY A  35
TYR A  50
GLN A  74
TYR A  76
ASP A  99
ASP A 136
 FMT  A 203 ( 3.5A)
KAN  A 201 ( 3.9A)
KAN  A 201 (-3.1A)
None
KAN  A 201 ( 3.9A)
KAN  A 201 (-3.8A)
 0.87A 2vqyA-4qc6A:
20.1		 2vqyA-4qc6A:
28.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2W8Y_A_486A1000_1
(PROGESTERONE
RECEPTOR)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		5 / 12 LEU A  83
GLY A  82
MET A 447
PHE A 168
VAL A 466
 None
FMT  A1802 ( 4.2A)
None
None
None
 1.35A 2w8yA-2c4mA:
undetectable		 2w8yA-2c4mA:
13.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2WEK_A_DIFA1373_1
(ZINC-BINDING ALCOHOL
DEHYDROGENASE
DOMAIN-CONTAINING
PROTEIN 2)		 3vdg PROBABLE GLUCARATE
DEHYDRATASE
(Mycolicibacteriu
m
smegmatis) 		4 / 8 ASN A 323
SER A 324
MET A 103
ASN A  25
 FMT  A 501 (-4.0A)
None
None
ACT  A 504 (-3.9A)
 1.25A 2wekA-3vdgA:
undetectable		 2wekA-3vdgA:
25.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2WEK_B_DIFB1373_1
(ZINC-BINDING ALCOHOL
DEHYDROGENASE
DOMAIN-CONTAINING
PROTEIN 2)		 3vdg PROBABLE GLUCARATE
DEHYDRATASE
(Mycolicibacteriu
m
smegmatis) 		4 / 8 ASN A 323
SER A 324
MET A 103
ASN A  25
 FMT  A 501 (-4.0A)
None
None
ACT  A 504 (-3.9A)
 1.25A 2wekB-3vdgA:
undetectable		 2wekB-3vdgA:
25.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2WGJ_A_VGHA2346_1
(HEPATOCYTE GROWTH
FACTOR RECEPTOR)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		6 / 12 GLY A  28
VAL A  35
ALA A  50
TYR A  99
ALA A 172
ASP A 173
 6A7  A 401 (-3.6A)
6A7  A 401 ( 4.5A)
6A7  A 401 (-3.3A)
6A7  A 401 (-4.9A)
6A7  A 401 ( 4.1A)
FMT  A 403 ( 3.3A)
 0.64A 2wgjA-5idnA:
15.4		 2wgjA-5idnA:
25.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2WX2_B_TPFB1460_1
(LANOSTEROL
14-ALPHA-DEMETHYLASE)		 5umu FACT COMPLEX SUBUNIT
SPT16
(Homo
sapiens) 		4 / 8 TYR A 864
MET A 906
THR A 894
LEU A 842
 None
None
FMT  A1006 (-3.7A)
FMT  A1003 ( 3.5A)
 0.78A 2wx2B-5umuA:
undetectable		 2wx2B-5umuA:
10.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X1L_A_ADNA601_1
(METHIONYL-TRNA
SYNTHETASE)		 3kmv ALPHA-L-ARABINOFURAN
OSIDASE B
(Ruminiclostridiu
m
thermocellum) 		5 / 11 ALA A  89
ALA A  92
GLY A  67
GLY A  84
ASP A  83
 None
None
None
None
FMT  A 160 (-3.0A)
 1.12A 2x1lA-3kmvA:
undetectable		 2x1lA-3kmvA:
14.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X1L_C_ADNC601_1
(METHIONYL-TRNA
SYNTHETASE)		 3kmv ALPHA-L-ARABINOFURAN
OSIDASE B
(Ruminiclostridiu
m
thermocellum) 		5 / 11 ALA A  89
ALA A  92
GLY A  67
GLY A  84
ASP A  83
 None
None
None
None
FMT  A 160 (-3.0A)
 1.12A 2x1lC-3kmvA:
undetectable		 2x1lC-3kmvA:
14.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X2I_C_QPSC1060_1
(ALPHA-1,4-GLUCAN
LYASE ISOZYME 1)		 2wda PUTATIVE SECRETED
LYASE
(Streptomyces
violaceoruber) 		5 / 12 THR A  38
VAL A 338
GLY A 262
ALA A 335
GLN A 255
 FMT  A1767 ( 4.3A)
None
None
None
PEG  A1775 (-3.5A)
 1.29A 2x2iC-2wdaA:
4.1		 2x2iC-2wdaA:
21.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X45_A_HSMA1160_1
(ALLERGEN ARG R 1)		 4it6 CG17282
(Drosophila
melanogaster) 		4 / 6 SER A  53
TYR A  55
VAL A  41
ASP A  80
 None
None
FMT  A 203 (-4.2A)
None
 1.37A 2x45A-4it6A:
undetectable		 2x45A-4it6A:
22.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X8O_A_OINA1314_1
(CHOLINE-BINDING
PROTEIN F)		 3c7o ENDO-1,4-BETA-XYLANA
SE
(Bacillus
subtilis) 		4 / 5 LYS A 318
ASP A  53
TYR A 320
GLU A  44
 FMT  A2060 ( 4.0A)
FMT  A2060 (-3.6A)
None
None
 1.28A 2x8oA-3c7oA:
undetectable		 2x8oA-3c7oA:
20.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2XNR_A_ACTA1001_0
(NUCLEAR
POLYADENYLATED
RNA-BINDING PROTEIN
3)		 1r4p SHIGA-LIKE TOXIN
TYPE II A SUBUNIT
(Escherichia
coli) 		3 / 3 SER A 183
ARG A 179
GLN A 180
 None
FMT  A3001 ( 3.9A)
None
 0.88A 2xnrA-1r4pA:
undetectable		 2xnrA-1r4pA:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2XPV_A_MIYA1209_1
(TETRACYCLINE
REPRESSOR PROTEIN
CLASS D)		 5odo ISOMERASE
(Rhodococcus
erythropolis) 		5 / 12 HIS A 401
HIS A 399
ARG A  76
ILE A 233
SER A 225
 None
None
FMT  A 607 (-3.6A)
None
None
 1.26A 2xpvA-5odoA:
undetectable		 2xpvA-5odoA:
17.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2XPW_A_OTCA222_1
(TETRACYCLINE
REPRESSOR PROTEIN
CLASS D)		 5odo ISOMERASE
(Rhodococcus
erythropolis) 		5 / 12 HIS A 401
HIS A 399
ARG A  76
ILE A 233
SER A 225
 None
None
FMT  A 607 (-3.6A)
None
None
 1.24A 2xpwA-5odoA:
undetectable		 2xpwA-5odoA:
17.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2XXG_A_CUA1338_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 3c9f 5'-NUCLEOTIDASE
(Candida
albicans) 		3 / 3 ASP A  80
HIS A 115
HIS A  36
 ZN  A 601 ( 2.7A)
FMT  A 607 (-4.0A)
None
 0.62A 2xxgA-3c9fA:
undetectable		 2xxgA-3c9fA:
20.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2XXG_A_CUA1338_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 3wia NITRITE REDUCTASE
(Geobacillus
kaustophilus) 		3 / 3 ASP A  98
HIS A 100
HIS A 134
 FMT  A 403 ( 3.4A)
CU  A 402 (-3.2A)
CU  A 402 ( 3.2A)
 0.15A 2xxgA-3wiaA:
30.1		 2xxgA-3wiaA:
29.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2XXG_C_CUC1339_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 3c9f 5'-NUCLEOTIDASE
(Candida
albicans) 		3 / 3 ASP A  80
HIS A 115
HIS A  36
 ZN  A 601 ( 2.7A)
FMT  A 607 (-4.0A)
None
 0.62A 2xxgC-3c9fA:
undetectable		 2xxgC-3c9fA:
20.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2XXG_C_CUC1339_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 3wia NITRITE REDUCTASE
(Geobacillus
kaustophilus) 		3 / 3 ASP A  98
HIS A 100
HIS A 134
 FMT  A 403 ( 3.4A)
CU  A 402 (-3.2A)
CU  A 402 ( 3.2A)
 0.12A 2xxgC-3wiaA:
30.0		 2xxgC-3wiaA:
29.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2XZ5_A_ACHA1211_0
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 4iqg SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE SDR
(Polaromonas
sp.
JS666) 		4 / 7 SER C 143
GLN C 153
ILE C 194
SER C 150
 NAP  C 304 (-3.3A)
None
NAP  C 304 (-3.2A)
FMT  C 301 (-3.1A)
 1.01A 2xz5A-4iqgC:
undetectable
2xz5B-4iqgC:
undetectable		 2xz5A-4iqgC:
21.13
2xz5B-4iqgC:
21.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2XZ5_B_ACHB1211_0
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 4iqg SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE SDR
(Polaromonas
sp.
JS666) 		4 / 8 SER C 143
GLN C 153
ILE C 194
SER C 150
 NAP  C 304 (-3.3A)
None
NAP  C 304 (-3.2A)
FMT  C 301 (-3.1A)
 0.96A 2xz5B-4iqgC:
undetectable
2xz5E-4iqgC:
undetectable		 2xz5B-4iqgC:
21.13
2xz5E-4iqgC:
21.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y00_B_Y00B601_1
(BETA-1 ADRENERGIC
RECEPTOR)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		5 / 12 LEU A 445
TRP A 465
THR A 457
ASP A 463
TYR A 198
 None
None
None
None
FMT  A1802 (-3.1A)
 1.34A 2y00B-2c4mA:
undetectable		 2y00B-2c4mA:
18.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y01_B_Y00B601_1
(BETA-1 ADRENERGIC
RECEPTOR)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		5 / 12 LEU A 445
TRP A 465
THR A 457
ASP A 463
TYR A 198
 None
None
None
None
FMT  A1802 (-3.1A)
 1.33A 2y01B-2c4mA:
undetectable		 2y01B-2c4mA:
18.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y6R_B_CTCB1385_0
(TETX2 PROTEIN)		 4qbu ZMAA
(Bacillus
cereus) 		4 / 8 ARG A 217
GLY A 350
GLY A 101
MET A 229
 FMT  A 500 (-2.9A)
None
None
None
 0.63A 2y6rB-4qbuA:
undetectable		 2y6rB-4qbuA:
20.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y7H_B_SAMB530_1
(TYPE I RESTRICTION
ENZYME ECOKI M
PROTEIN)		 1vp4 AMINOTRANSFERASE,
PUTATIVE
(Thermotoga
maritima) 		3 / 3 TYR A  90
GLU A 214
THR A 192
 None
None
FMT  A 608 (-4.7A)
 0.91A 2y7hB-1vp4A:
2.5		 2y7hB-1vp4A:
22.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y7K_A_SALA1302_1
(LYSR-TYPE REGULATORY
PROTEIN)		 5mrt LYTIC ENDOPEPTIDASE
PREPROENZYME
(Lysobacter
sp.
XL1) 		5 / 11 TYR A   9
PHE A  35
GLY A  56
PHE A  58
PRO A  12
 None
None
FMT  A 303 ( 4.4A)
None
None
 1.29A 2y7kA-5mrtA:
undetectable		 2y7kA-5mrtA:
15.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y7W_B_SALB1300_1
(LYSR-TYPE REGULATORY
PROTEIN)		 3c9f 5'-NUCLEOTIDASE
(Candida
albicans) 		5 / 10 THR A  33
GLY A 248
GLY A  79
HIS A  36
PRO A 445
 None
None
None
None
FMT  A 607 ( 4.6A)
 1.42A 2y7wB-3c9fA:
undetectable		 2y7wB-3c9fA:
18.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2YA7_C_ZMRC1776_1
(NEURAMINIDASE A)		 4lmw GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		5 / 12 ILE A  11
ASP A  10
LEU A 126
ARG A 153
TYR A  46
 None
None
None
FMT  A 305 ( 4.0A)
FMT  A 301 ( 4.9A)
 1.11A 2ya7C-4lmwA:
undetectable		 2ya7C-4lmwA:
20.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Z0A_A_GLYA73_0
(NONSTRUCTURAL
PROTEIN 1)		 4isa UDP-3-O-[3-HYDROXYMY
RISTOYL]
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Escherichia
coli) 		4 / 5 ALA A 181
GLN A 185
ILE A 186
ARG A 237
 FMT  A 406 (-3.8A)
FMT  A 406 ( 3.8A)
None
None
 1.38A 2z0aA-4isaA:
undetectable		 2z0aA-4isaA:
13.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZIF_B_SAMB298_1
(PUTATIVE
MODIFICATION
METHYLASE)		 3gjy SPERMIDINE SYNTHASE
(Corynebacterium
glutamicum) 		3 / 3 ASP A 144
THR A  99
GLU A 117
 None
None
FMT  A 315 (-3.6A)
 0.58A 2zifB-3gjyA:
2.5		 2zifB-3gjyA:
22.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZTH_A_SAMA305_1
(CATECHOL
O-METHYLTRANSFERASE)		 4ihc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Dickeya
paradisiaca) 		3 / 3 SER A 272
GLU A 352
ASP A 250
 None
FMT  A 503 (-3.2A)
MG  A 501 ( 4.8A)
 0.84A 2zthA-4ihcA:
2.3		 2zthA-4ihcA:
21.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3A25_A_SAMA279_1
(UNCHARACTERIZED
PROTEIN PH0793)		 6cza

(;
) 		3 / 3 MET A  75
GLU B  25
ASP B 168
 FMT  A 907 ( 4.6A)
None
None
 1.06A 3a25A-6czaA:
undetectable		 3a25A-6czaA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3A50_C_VD3C2001_1
(VITAMIN D
HYDROXYLASE)		 3fz4 PUTATIVE ARSENATE
REDUCTASE
(Streptococcus
mutans) 		5 / 11 ILE A  92
LEU A  51
LEU A  96
ILE A 103
LEU A  46
 None
None
None
FMT  A 205 (-4.6A)
None
 1.07A 3a50C-3fz4A:
undetectable		 3a50C-3fz4A:
17.40
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3A50_D_VD3D2001_1
(VITAMIN D
HYDROXYLASE)		 4j6c CYTOCHROME P450
MONOOXYGENASE
(Nocardia
farcinica) 		5 / 12 ILE A  12
LEU A 396
LEU A 294
ALA A  44
THR A  46
 None
FMT  A 504 (-4.4A)
HEM  A 502 ( 4.0A)
None
None
 1.04A 3a50D-4j6cA:
46.2		 3a50D-4j6cA:
33.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3A50_E_VD3E2001_1
(VITAMIN D
HYDROXYLASE)		 3fz4 PUTATIVE ARSENATE
REDUCTASE
(Streptococcus
mutans) 		5 / 12 ILE A  92
LEU A  51
LEU A  96
ILE A 103
LEU A  46
 None
None
None
FMT  A 205 (-4.6A)
None
 1.04A 3a50E-3fz4A:
undetectable		 3a50E-3fz4A:
17.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3A65_A_ACAA601_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)		 3zs3 THAUMATIN-LIKE
PROTEIN
(Malus
domestica) 		5 / 12 ALA A  82
VAL A  77
SER A  74
ASN A  80
GLY A  83
 None
FMT  A1231 (-4.2A)
None
None
None
 1.25A 3a65A-3zs3A:
undetectable		 3a65A-3zs3A:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AQI_B_CHDB5_0
(FERROCHELATASE)		 4udr GLUCOSE-METHANOL-CHO
LINE OXIDOREDUCTASE
(Methylovorus
sp.
MP688) 		3 / 3 PRO A 272
LEU A 275
ARG A 297
 None
None
FMT  A1530 (-3.0A)
 0.84A 3aqiB-4udrA:
undetectable		 3aqiB-4udrA:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AXZ_A_ADNA401_1
(TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE)		 3s9j MEMBER OF DUF4221
FAMILY
(Bacteroides
vulgatus) 		5 / 12 TYR A 217
GLY A 274
ILE A 176
GLY A 223
GLY A 222
 None
None
None
FMT  A 404 ( 3.2A)
GOL  A 416 ( 3.3A)
 1.07A 3axzA-3s9jA:
undetectable		 3axzA-3s9jA:
18.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3B6H_A_MXDA551_1
(PROSTACYCLIN
SYNTHASE)		 1qwr MANNOSE-6-PHOSPHATE
ISOMERASE
(Bacillus
subtilis) 		4 / 6 ALA A 179
LEU A 180
ALA A  21
THR A  20
 None
FMT  A 606 ( 4.4A)
FMT  A 606 ( 4.6A)
None
 0.85A 3b6hA-1qwrA:
undetectable		 3b6hA-1qwrA:
19.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3B6H_A_MXDA551_1
(PROSTACYCLIN
SYNTHASE)		 6b1z GLUTAMATE--TRNA
LIGASE
(Elizabethkingia
anophelis) 		4 / 6 ALA A  61
LEU A  62
ALA A  24
THR A  23
 None
None
None
FMT  A 608 ( 4.4A)
 0.87A 3b6hA-6b1zA:
undetectable		 3b6hA-6b1zA:
23.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3B6H_B_MXDB551_1
(PROSTACYCLIN
SYNTHASE)		 1qwr MANNOSE-6-PHOSPHATE
ISOMERASE
(Bacillus
subtilis) 		4 / 6 ALA A 179
LEU A 180
ALA A  21
THR A  20
 None
FMT  A 606 ( 4.4A)
FMT  A 606 ( 4.6A)
None
 0.88A 3b6hB-1qwrA:
undetectable		 3b6hB-1qwrA:
19.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3B6H_B_MXDB551_1
(PROSTACYCLIN
SYNTHASE)		 6b1z GLUTAMATE--TRNA
LIGASE
(Elizabethkingia
anophelis) 		4 / 6 ALA A  61
LEU A  62
ALA A  24
THR A  23
 None
None
None
FMT  A 608 ( 4.4A)
 0.90A 3b6hB-6b1zA:
undetectable		 3b6hB-6b1zA:
23.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3B9L_A_AZZA1010_1
(SERUM ALBUMIN)		 1vp4 AMINOTRANSFERASE,
PUTATIVE
(Thermotoga
maritima) 		4 / 8 LEU A 201
ILE A 231
ARG A 239
GLY A 236
 None
None
None
FMT  A 609 ( 4.7A)
 0.90A 3b9lA-1vp4A:
undetectable		 3b9lA-1vp4A:
21.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3B9M_A_SALA1100_1
(SERUM ALBUMIN)		 5odo ISOMERASE
(Rhodococcus
erythropolis) 		4 / 4 LEU A 389
ARG A  76
LEU A 380
ALA A 192
 None
FMT  A 607 (-3.6A)
None
FMT  A 607 ( 4.4A)
 1.05A 3b9mA-5odoA:
undetectable		 3b9mA-5odoA:
20.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BC9_A_ACRA901_1
(ALPHA AMYLASE,
CATALYTIC REGION)		 6fsa -
(-) 		4 / 7 ASP A 599
SER A 271
LYS A 270
ASP A 282
 None
FMT  A2004 (-2.7A)
None
None
 1.26A 3bc9A-6fsaA:
undetectable		 3bc9A-6fsaA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BJW_G_SVRG506_1
(PHOSPHOLIPASE A2)		 1vp4 AMINOTRANSFERASE,
PUTATIVE
(Thermotoga
maritima) 		4 / 8 VAL A 403
GLY A 407
LYS A 408
ARG A 400
 None
None
None
FMT  A 620 ( 3.5A)
 0.83A 3bjwA-1vp4A:
undetectable		 3bjwA-1vp4A:
15.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BJW_G_SVRG506_2
(PHOSPHOLIPASE A2)		 4rmf ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycolicibacteriu
m
smegmatis) 		4 / 5 VAL A 419
VAL A 420
PHE A 416
ARG A 489
 None
None
None
FMT  A 702 (-2.7A)
 1.31A 3bjwB-4rmfA:
undetectable		 3bjwB-4rmfA:
11.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BOG_D_DHID32_0
(6.5 KDA GLYCINE-RICH
ANTIFREEZE PROTEIN)		 4b6m TUBULIN-SPECIFIC
CHAPERONE, PUTATIVE
(Trypanosoma
brucei) 		5 / 6 GLY A 197
GLY A 214
GLY A 215
GLY A 199
GLY A 187
 None
None
FMT  A1233 (-3.6A)
None
None
 0.92A 3bogB-4b6mA:
undetectable
3bogD-4b6mA:
undetectable		 3bogB-4b6mA:
undetectable
3bogD-4b6mA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BOY_A_HISA1001_0
(HUT OPERON POSITIVE
REGULATORY PROTEIN)		 3gip N-ACYL-D-GLUTAMATE
DEACYLASE
(Bordetella
bronchiseptica) 		5 / 10 GLY A 366
HIS A  68
HIS A  66
TYR A 282
HIS A 248
 None
ACY  A 481 (-4.8A)
ACY  A 481 ( 4.9A)
FMT  A 482 (-4.4A)
ZN  A 484 (-3.3A)
 1.09A 3boyA-3gipA:
undetectable
3boyC-3gipA:
undetectable		 3boyA-3gipA:
14.38
3boyC-3gipA:
14.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BOY_A_HISA2001_0
(HUT OPERON POSITIVE
REGULATORY PROTEIN)		 3gip N-ACYL-D-GLUTAMATE
DEACYLASE
(Bordetella
bronchiseptica) 		5 / 10 HIS A  66
TYR A 282
HIS A 248
GLY A 366
HIS A  68
 ACY  A 481 ( 4.9A)
FMT  A 482 (-4.4A)
ZN  A 484 (-3.3A)
None
ACY  A 481 (-4.8A)
 1.09A 3boyA-3gipA:
undetectable
3boyB-3gipA:
undetectable		 3boyA-3gipA:
14.38
3boyB-3gipA:
14.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BOY_A_HISA3001_0
(HUT OPERON POSITIVE
REGULATORY PROTEIN)		 3gip N-ACYL-D-GLUTAMATE
DEACYLASE
(Bordetella
bronchiseptica) 		5 / 10 HIS A  66
TYR A 282
HIS A 248
GLY A 366
HIS A  68
 ACY  A 481 ( 4.9A)
FMT  A 482 (-4.4A)
ZN  A 484 (-3.3A)
None
ACY  A 481 (-4.8A)
 1.08A 3boyB-3gipA:
undetectable
3boyC-3gipA:
undetectable		 3boyB-3gipA:
14.38
3boyC-3gipA:
14.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BWM_A_SAMA301_1
(CATECHOL
O-METHYLTRANSFERASE)		 4ihc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Dickeya
paradisiaca) 		3 / 3 SER A 272
GLU A 352
ASP A 250
 None
FMT  A 503 (-3.2A)
MG  A 501 ( 4.8A)
 0.72A 3bwmA-4ihcA:
undetectable		 3bwmA-4ihcA:
20.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BWY_A_SAMA301_1
(COMT PROTEIN)		 4ihc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Dickeya
paradisiaca) 		3 / 3 SER A 272
GLU A 352
ASP A 250
 None
FMT  A 503 (-3.2A)
MG  A 501 ( 4.8A)
 0.75A 3bwyA-4ihcA:
undetectable		 3bwyA-4ihcA:
20.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CJT_K_SAMK302_0
(RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE)		 1u60 PROBABLE GLUTAMINASE
YBAS
(Escherichia
coli) 		5 / 12 GLY A 264
ILE A 266
SER A 260
ASN A  26
LEU A 283
 None
None
None
None
FMT  A1212 ( 4.5A)
 0.91A 3cjtK-1u60A:
undetectable		 3cjtK-1u60A:
23.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CJT_O_SAMO302_0
(RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE)		 3wdb PROBABLE
ATP-DEPENDENT CLP
PROTEASE ATP-BINDING
SUBUNIT
(Mycobacterium
tuberculosis) 		5 / 12 GLY A 116
GLY A 118
VAL A 123
LEU A 124
LEU A  90
 None
FMT  A2000 (-3.4A)
None
None
None
 0.89A 3cjtO-3wdbA:
undetectable		 3cjtO-3wdbA:
22.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CYX_A_ROCA201_2
(HIV-1 PROTEASE)		 2yn2 UNCHARACTERIZED
PROTEIN YNL108C
(Saccharomyces
cerevisiae) 		3 / 3 ARG A  14
VAL A  90
THR A 171
 FMT  A1264 (-4.0A)
None
None
 0.85A 3cyxA-2yn2A:
undetectable		 3cyxA-2yn2A:
17.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3D1Z_B_017B201_2
(HIV-1 PROTEASE)		 3lp6 PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE
CATALYTIC SUBUNIT
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  71
ALA A  70
ASP A  19
GLY A 122
ILE A 121
 FMT  A 175 (-4.1A)
FMT  A 175 ( 4.3A)
FMT  A 175 (-3.5A)
None
None
 1.01A 3d1zB-3lp6A:
undetectable		 3d1zB-3lp6A:
21.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3D1Z_B_017B201_2
(HIV-1 PROTEASE)		 3opq PHOSPHORIBOSYLAMINOI
MIDAZOLE
CARBOXYLASE,CATALYTI
C SUBUNIT
(Francisella
tularensis) 		5 / 12 GLY A  66
ALA A  65
ASP A  14
GLY A 117
ILE A 116
 PO4  A 164 (-3.7A)
PO4  A 164 (-3.3A)
PO4  A 164 (-2.8A)
FMT  A 166 (-3.3A)
None
 1.03A 3d1zB-3opqA:
undetectable		 3d1zB-3opqA:
22.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3D2T_A_1FLA502_1
(TRANSTHYRETIN)		 1r4p SHIGA-LIKE TOXIN
TYPE II A SUBUNIT
(Escherichia
coli) 		4 / 7 LEU A 123
SER A 126
THR A 190
VAL A 188
 None
None
None
FMT  A3013 ( 4.7A)
 0.88A 3d2tA-1r4pA:
undetectable		 3d2tA-1r4pA:
17.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3D41_A_FCNA4001_1
(FOMA PROTEIN)		 3q3v PHOSPHOGLYCERATE
KINASE
(Campylobacter
jejuni) 		4 / 8 GLY A 321
GLY A 198
GLY A 222
SER A 335
 None
None
FMT  A 403 ( 4.3A)
None
 0.70A 3d41A-3q3vA:
3.9		 3d41A-3q3vA:
22.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3DCJ_B_THHB401_0
(PROBABLE
5'-PHOSPHORIBOSYLGLY
CINAMIDE
FORMYLTRANSFERASE
PURN)		 5es6 LINEAR GRAMICIDIN
SYNTHASE SUBUNIT A
(Brevibacillus
parabrevis) 		4 / 8 SER A  50
ILE A  56
LEU A  57
ASN A  71
 FMT  A 703 ( 3.6A)
None
FMT  A 703 ( 4.5A)
FMT  A 702 (-3.0A)
 0.77A 3dcjB-5es6A:
12.7		 3dcjB-5es6A:
17.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3DD1_A_CFFA903_1
(GLYCOGEN
PHOSPHORYLASE, LIVER
FORM)		 3ll7 PUTATIVE
METHYLTRANSFERASE
(Porphyromonas
gingivalis) 		4 / 6 PHE A 269
HIS A 295
ALA A 301
GLY A 302
 None
FMT  A 504 ( 4.1A)
None
None
 1.06A 3dd1A-3ll7A:
undetectable		 3dd1A-3ll7A:
19.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3DD1_B_CFFB903_1
(GLYCOGEN
PHOSPHORYLASE, LIVER
FORM)		 3ll7 PUTATIVE
METHYLTRANSFERASE
(Porphyromonas
gingivalis) 		4 / 6 PHE A 269
HIS A 295
ALA A 301
GLY A 302
 None
FMT  A 504 ( 4.1A)
None
None
 1.05A 3dd1B-3ll7A:
undetectable		 3dd1B-3ll7A:
19.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3DDS_A_CFFA904_1
(GLYCOGEN
PHOSPHORYLASE, LIVER
FORM)		 3ll7 PUTATIVE
METHYLTRANSFERASE
(Porphyromonas
gingivalis) 		4 / 6 PHE A 269
HIS A 295
ALA A 301
GLY A 302
 None
FMT  A 504 ( 4.1A)
None
None
 1.07A 3ddsA-3ll7A:
undetectable		 3ddsA-3ll7A:
19.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3DDS_B_CFFB903_1
(GLYCOGEN
PHOSPHORYLASE, LIVER
FORM)		 3ll7 PUTATIVE
METHYLTRANSFERASE
(Porphyromonas
gingivalis) 		4 / 6 PHE A 269
HIS A 295
ALA A 301
GLY A 302
 None
FMT  A 504 ( 4.1A)
None
None
 1.07A 3ddsB-3ll7A:
undetectable		 3ddsB-3ll7A:
19.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3DDW_A_CFFA903_1
(GLYCOGEN
PHOSPHORYLASE, LIVER
FORM)		 3ll7 PUTATIVE
METHYLTRANSFERASE
(Porphyromonas
gingivalis) 		4 / 6 PHE A 269
HIS A 295
ALA A 301
GLY A 302
 None
FMT  A 504 ( 4.1A)
None
None
 1.04A 3ddwA-3ll7A:
undetectable		 3ddwA-3ll7A:
19.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3DDW_B_CFFB903_1
(GLYCOGEN
PHOSPHORYLASE, LIVER
FORM)		 3ll7 PUTATIVE
METHYLTRANSFERASE
(Porphyromonas
gingivalis) 		4 / 6 PHE A 269
HIS A 295
ALA A 301
GLY A 302
 None
FMT  A 504 ( 4.1A)
None
None
 1.08A 3ddwB-3ll7A:
undetectable		 3ddwB-3ll7A:
19.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EIG_A_MTXA200_1
(DIHYDROFOLATE
REDUCTASE)		 2qkd ZINC FINGER PROTEIN
ZPR1
(Mus
musculus) 		5 / 12 ILE A 361
LEU A 325
GLU A 334
SER A 412
ASN A 406
 None
None
FMT  A 778 (-4.4A)
None
FMT  A 778 (-3.8A)
 1.43A 3eigA-2qkdA:
undetectable		 3eigA-2qkdA:
19.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EKT_B_017B200_1
(PROTEASE)		 3lp6 PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE
CATALYTIC SUBUNIT
(Mycobacterium
tuberculosis) 		5 / 9 GLY A  71
ALA A  70
ASP A  19
GLY A 122
ILE A 121
 FMT  A 175 (-4.1A)
FMT  A 175 ( 4.3A)
FMT  A 175 (-3.5A)
None
None
 1.07A 3ektA-3lp6A:
undetectable		 3ektA-3lp6A:
17.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EKY_A_DR7A100_1
(PROTEASE)		 3lp6 PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE
CATALYTIC SUBUNIT
(Mycobacterium
tuberculosis) 		5 / 10 GLY A  71
ALA A  70
ASP A  19
GLY A 122
ILE A 121
 FMT  A 175 (-4.1A)
FMT  A 175 ( 4.3A)
FMT  A 175 (-3.5A)
None
None
 0.99A 3ekyA-3lp6A:
undetectable		 3ekyA-3lp6A:
17.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EL5_B_1UNB201_2
(PROTEASE)		 2gqw FERREDOXIN REDUCTASE
(Pseudomonas
sp.
KKS102) 		5 / 12 GLY A 121
ALA A 122
VAL A 231
THR A 128
VAL A 126
 None
FMT  A2002 (-3.7A)
None
GOL  A1001 (-4.3A)
None
 0.93A 3el5B-2gqwA:
undetectable		 3el5B-2gqwA:
11.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EL9_A_DR7A100_2
(PROTEASE)		 3lp6 PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE
CATALYTIC SUBUNIT
(Mycobacterium
tuberculosis) 		5 / 10 GLY A  71
ALA A  70
ASP A  19
GLY A 122
ILE A 121
 FMT  A 175 (-4.1A)
FMT  A 175 ( 4.3A)
FMT  A 175 (-3.5A)
None
None
 0.99A 3el9B-3lp6A:
undetectable		 3el9B-3lp6A:
17.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EL9_A_DR7A100_2
(PROTEASE)		 3opq PHOSPHORIBOSYLAMINOI
MIDAZOLE
CARBOXYLASE,CATALYTI
C SUBUNIT
(Francisella
tularensis) 		5 / 10 GLY A  66
ALA A  65
ASP A  14
GLY A 117
ILE A 116
 PO4  A 164 (-3.7A)
PO4  A 164 (-3.3A)
PO4  A 164 (-2.8A)
FMT  A 166 (-3.3A)
None
 1.05A 3el9B-3opqA:
undetectable		 3el9B-3opqA:
18.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EM0_B_CHDB500_0
(ILEAL BILE
ACID-BINDING PROTEIN)		 6b3p AMY13K
([Eubacterium]
rectale) 		4 / 7 THR A 306
VAL A 332
THR A 334
VAL A 280
 None
FMT  A 421 (-4.1A)
EDO  A 411 ( 3.8A)
EDO  A 411 (-4.1A)
 0.41A 3em0B-6b3pA:
undetectable		 3em0B-6b3pA:
19.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ETE_A_H3PA552_1
(GLUTAMATE
DEHYDROGENASE)		 3tdg PUTATIVE
UNCHARACTERIZED
PROTEIN
(Helicobacter
pylori) 		4 / 6 ILE A 215
TYR A 222
MET A 201
ILE A 137
 None
None
None
FMT  A 360 (-4.6A)
 1.16A 3eteA-3tdgA:
undetectable
3eteE-3tdgA:
undetectable		 3eteA-3tdgA:
20.44
3eteE-3tdgA:
20.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ETE_C_H3PC552_1
(GLUTAMATE
DEHYDROGENASE)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		3 / 3 TYR A 229
TYR A 101
GLY A 257
 None
FMT  A 501 (-4.6A)
None
 0.69A 3eteB-4kv7A:
4.6
3eteD-4kv7A:
5.0
3eteF-4kv7A:
4.6		 3eteB-4kv7A:
24.95
3eteD-4kv7A:
24.95
3eteF-4kv7A:
24.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ETE_C_H3PC554_1
(GLUTAMATE
DEHYDROGENASE)		 3tdg PUTATIVE
UNCHARACTERIZED
PROTEIN
(Helicobacter
pylori) 		4 / 5 ILE A 215
TYR A 222
MET A 201
ILE A 137
 None
None
None
FMT  A 360 (-4.6A)
 1.15A 3eteB-3tdgA:
undetectable
3eteC-3tdgA:
undetectable		 3eteB-3tdgA:
20.44
3eteC-3tdgA:
20.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ETE_F_H3PF552_1
(GLUTAMATE
DEHYDROGENASE)		 3tdg PUTATIVE
UNCHARACTERIZED
PROTEIN
(Helicobacter
pylori) 		4 / 7 MET A 201
ILE A 137
ILE A 215
TYR A 222
 None
FMT  A 360 (-4.6A)
None
None
 1.15A 3eteD-3tdgA:
undetectable
3eteF-3tdgA:
undetectable		 3eteD-3tdgA:
20.44
3eteF-3tdgA:
20.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FXR_A_ASCA3001_0
(LYSR TYPE REGULATOR
OF TSAMBCD)		 3fxq LYSR TYPE REGULATOR
OF TSAMBCD
(Comamonas
testosteroni) 		8 / 8 HIS A 150
ARG A 199
ALA A 203
ILE A 204
ASN A 207
ARG A 211
PRO A 266
PRO A 268
 CL  A4002 (-4.2A)
None
CL  A4002 ( 4.0A)
FMT  A3001 (-4.1A)
None
None
None
None
 0.54A 3fxrA-3fxqA:
35.9		 3fxrA-3fxqA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FXR_A_ASCA3001_0
(LYSR TYPE REGULATOR
OF TSAMBCD)		 3fxq LYSR TYPE REGULATOR
OF TSAMBCD
(Comamonas
testosteroni) 		5 / 8 HIS A 150
ARG A 199
ALA A 203
ILE A 204
PRO A 268
 CL  A4002 (-4.2A)
None
CL  A4002 ( 4.0A)
FMT  A3001 (-4.1A)
None
 1.50A 3fxrA-3fxqA:
35.9		 3fxrA-3fxqA:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3FZG_A_SAMA300_0
(16S RRNA METHYLASE)		 5eso 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 THR A 300
GLY A 231
GLY A 233
LEU A 275
VAL A 307
 None
None
FMT  A 603 ( 4.7A)
None
None
 0.95A 3fzgA-5esoA:
undetectable		 3fzgA-5esoA:
13.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GGU_B_017B201_2
(PROTEASE)		 3lp6 PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE
CATALYTIC SUBUNIT
(Mycobacterium
tuberculosis) 		5 / 9 GLY A  71
ALA A  70
ASP A  19
GLY A 122
ILE A 121
 FMT  A 175 (-4.1A)
FMT  A 175 ( 4.3A)
FMT  A 175 (-3.5A)
None
None
 1.02A 3gguB-3lp6A:
undetectable		 3gguB-3lp6A:
18.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GGU_B_017B201_2
(PROTEASE)		 3opq PHOSPHORIBOSYLAMINOI
MIDAZOLE
CARBOXYLASE,CATALYTI
C SUBUNIT
(Francisella
tularensis) 		5 / 9 GLY A  66
ALA A  65
ASP A  14
GLY A 117
ILE A 116
 PO4  A 164 (-3.7A)
PO4  A 164 (-3.3A)
PO4  A 164 (-2.8A)
FMT  A 166 (-3.3A)
None
 1.06A 3gguB-3opqA:
undetectable		 3gguB-3opqA:
18.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GN0_A_DMOA551_1
(ARGINASE-1)		 3vdg PROBABLE GLUCARATE
DEHYDRATASE
(Mycolicibacteriu
m
smegmatis) 		5 / 9 HIS A 321
ASP A 348
HIS A 350
ASP A 222
GLU A 247
 FMT  A 501 (-4.0A)
None
ACT  A 504 (-4.0A)
NA  A 502 (-2.9A)
NA  A 502 (-3.1A)
 1.33A 3gn0A-3vdgA:
undetectable		 3gn0A-3vdgA:
23.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GN0_B_DMOB552_1
(ARGINASE-1)		 3vdg PROBABLE GLUCARATE
DEHYDRATASE
(Mycolicibacteriu
m
smegmatis) 		5 / 9 HIS A 321
ASP A 348
HIS A 350
ASP A 222
GLU A 247
 FMT  A 501 (-4.0A)
None
ACT  A 504 (-4.0A)
NA  A 502 (-2.9A)
NA  A 502 (-3.1A)
 1.35A 3gn0B-3vdgA:
undetectable		 3gn0B-3vdgA:
23.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3GP0_A_NILA1_1
(MITOGEN-ACTIVATED
PROTEIN KINASE 11)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		7 / 12 VAL A  35
ALA A  50
GLU A  66
LEU A  69
LEU A  70
ILE A  79
HIS A 149
 6A7  A 401 ( 4.5A)
6A7  A 401 (-3.3A)
FMT  A 404 ( 4.2A)
None
None
6A7  A 401 (-4.2A)
FMT  A 403 (-4.6A)
 0.95A 3gp0A-5idnA:
13.8		 3gp0A-5idnA:
31.83
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3GP0_A_NILA1_1
(MITOGEN-ACTIVATED
PROTEIN KINASE 11)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		7 / 12 VAL A  35
ALA A  50
GLU A  66
LEU A  70
ILE A  79
HIS A 149
ASP A 173
 6A7  A 401 ( 4.5A)
6A7  A 401 (-3.3A)
FMT  A 404 ( 4.2A)
None
6A7  A 401 (-4.2A)
FMT  A 403 (-4.6A)
FMT  A 403 ( 3.3A)
 1.15A 3gp0A-5idnA:
13.8		 3gp0A-5idnA:
31.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GRV_A_ADNA300_1
(DIMETHYLADENOSINE
TRANSFERASE)		 3gjy SPERMIDINE SYNTHASE
(Corynebacterium
glutamicum) 		6 / 11 GLY A  94
GLU A 117
ASP A 119
LEU A 122
ASP A 144
ALA A 145
 None
FMT  A 315 (-3.6A)
None
FMT  A 315 (-4.0A)
None
None
 0.84A 3grvA-3gjyA:
3.1		 3grvA-3gjyA:
20.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GRV_A_ADNA300_1
(DIMETHYLADENOSINE
TRANSFERASE)		 3gjy SPERMIDINE SYNTHASE
(Corynebacterium
glutamicum) 		6 / 11 GLY A  94
GLY A  96
GLU A 117
LEU A 122
ASP A 144
ALA A 145
 None
FMT  A 315 ( 4.2A)
FMT  A 315 (-3.6A)
FMT  A 315 (-4.0A)
None
None
 1.00A 3grvA-3gjyA:
3.1		 3grvA-3gjyA:
20.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GRY_A_SAMA300_0
(DIMETHYLADENOSINE
TRANSFERASE)		 3gjy SPERMIDINE SYNTHASE
(Corynebacterium
glutamicum) 		6 / 12 GLY A  94
GLU A 117
ASP A 119
LEU A 122
ASP A 144
ALA A 145
 None
FMT  A 315 (-3.6A)
None
FMT  A 315 (-4.0A)
None
None
 0.79A 3gryA-3gjyA:
11.0		 3gryA-3gjyA:
20.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GRY_A_SAMA300_0
(DIMETHYLADENOSINE
TRANSFERASE)		 3gjy SPERMIDINE SYNTHASE
(Corynebacterium
glutamicum) 		6 / 12 GLY A  94
GLY A  96
GLU A 117
LEU A 122
ASP A 144
ALA A 145
 None
FMT  A 315 ( 4.2A)
FMT  A 315 (-3.6A)
FMT  A 315 (-4.0A)
None
None
 0.91A 3gryA-3gjyA:
11.0		 3gryA-3gjyA:
20.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GWX_B_EPAB3_2
(PROTEIN (PEROXISOME
PROLIFERATOR
ACTIVATED RECEPTOR
(PPAR-DELTA)))		 4uug AMINE TRANSAMINASE
(Aspergillus
fumigatus) 		5 / 12 LEU A 203
PHE A 174
GLN A 182
ILE A 117
MET A  85
 None
None
None
None
FMT  A 405 (-4.7A)
 1.01A 3gwxB-4uugA:
undetectable		 3gwxB-4uugA:
22.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HCN_A_CHDA3_0
(FERROCHELATASE,
MITOCHONDRIAL)		 1vp4 AMINOTRANSFERASE,
PUTATIVE
(Thermotoga
maritima) 		4 / 7 MET A 315
LEU A 319
PRO A 387
GLY A  37
 None
None
None
FMT  A 607 (-4.6A)
 1.04A 3hcnA-1vp4A:
2.0		 3hcnA-1vp4A:
20.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3HEG_A_BAXA1_1
(MITOGEN-ACTIVATED
PROTEIN KINASE 14)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		6 / 12 VAL A  27
VAL A  35
ALA A  50
LYS A  52
GLU A  66
ILE A  79
 6A7  A 401 (-4.7A)
6A7  A 401 ( 4.5A)
6A7  A 401 (-3.3A)
6A7  A 401 ( 2.9A)
FMT  A 404 ( 4.2A)
6A7  A 401 (-4.2A)
 0.74A 3hegA-5idnA:
20.9		 3hegA-5idnA:
32.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3HEG_A_BAXA1_1
(MITOGEN-ACTIVATED
PROTEIN KINASE 14)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		6 / 12 VAL A  35
ALA A  50
LYS A  52
GLU A  66
LEU A  70
ILE A  79
 6A7  A 401 ( 4.5A)
6A7  A 401 (-3.3A)
6A7  A 401 ( 2.9A)
FMT  A 404 ( 4.2A)
None
6A7  A 401 (-4.2A)
 1.00A 3hegA-5idnA:
20.9		 3hegA-5idnA:
32.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HS4_A_AZMA702_1
(CARBONIC ANHYDRASE 2)		 3geu INTERCELLULAR
ADHESION PROTEIN R
(Staphylococcus
aureus) 		4 / 7 LYS A  44
TYR A  18
GLU A 104
PRO A 103
 FMT  A 188 (-2.6A)
None
None
None
 0.98A 3hs4A-3geuA:
undetectable		 3hs4A-3geuA:
21.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ID5_B_SAMB301_0
(FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE)		 3gjy SPERMIDINE SYNTHASE
(Corynebacterium
glutamicum) 		5 / 11 GLY A  94
GLU A 117
ASP A 144
ALA A 145
ASP A 163
 None
FMT  A 315 (-3.6A)
None
None
None
 0.74A 3id5B-3gjyA:
10.3		 3id5B-3gjyA:
21.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ID5_F_SAMF301_0
(FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE)		 3gjy SPERMIDINE SYNTHASE
(Corynebacterium
glutamicum) 		5 / 11 GLY A  94
GLU A 117
ASP A 144
ALA A 145
ASP A 163
 None
FMT  A 315 (-3.6A)
None
None
None
 0.74A 3id5F-3gjyA:
10.3		 3id5F-3gjyA:
21.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ID6_C_SAMC301_0
(FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE)		 3gjy SPERMIDINE SYNTHASE
(Corynebacterium
glutamicum) 		5 / 12 GLY A  94
GLU A 117
ASP A 144
ALA A 145
ASP A 163
 None
FMT  A 315 (-3.6A)
None
None
None
 0.74A 3id6C-3gjyA:
10.3		 3id6C-3gjyA:
21.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IHZ_A_FK5A501_2
(70 KDA
PEPTIDYLPROLYL
ISOMERASE, PUTATIVE)		 6beg SCAFFOLD PROTEIN D13
(Vaccinia
virus) 		4 / 8 ASP A 425
TYR A 273
GLY A  85
ILE A 192
 FMT  A 601 (-3.7A)
None
None
None
 0.73A 3ihzB-6begA:
undetectable		 3ihzB-6begA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ITA_D_AICD501_1
(D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE
DACC)		 3s9j MEMBER OF DUF4221
FAMILY
(Bacteroides
vulgatus) 		3 / 3 PRO A 146
PHE A 143
ALA A 193
 FMT  A 410 ( 3.8A)
None
None
 0.68A 3itaD-3s9jA:
undetectable		 3itaD-3s9jA:
21.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IV6_A_SAMA301_1
(PUTATIVE
ZN-DEPENDENT ALCOHOL
DEHYDROGENASE)		 3pei CYTOSOL
AMINOPEPTIDASE
(Francisella
tularensis) 		3 / 3 SER A 452
ASP A 395
ASP A 448
 None
FMT  A 501 (-3.8A)
None
 0.80A 3iv6A-3peiA:
undetectable		 3iv6A-3peiA:
21.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IV6_D_SAMD301_0
(PUTATIVE
ZN-DEPENDENT ALCOHOL
DEHYDROGENASE)		 5hjr NEUTRAL
ALPHA-GLUCOSIDASE AB
(Mus
musculus) 		5 / 12 THR A 735
SER A 842
ASP A 847
ILE A 909
LEU A 868
 FMT  A1016 ( 3.7A)
None
None
None
None
 1.24A 3iv6D-5hjrA:
undetectable		 3iv6D-5hjrA:
15.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3J7Z_A_ERYA9000_0
(23S RRNA
50S RIBOSOMAL
PROTEIN L22
ERMCL NASCENT CHAIN)		 3l0g NICOTINATE-NUCLEOTID
E PYROPHOSPHORYLASE
(Ehrlichia
chaffeensis) 		3 / 3 LYS A 163
ILE A 260
PHE A 264
 FMT  A 301 (-3.3A)
None
None
 0.75A 3j7zS-3l0gA:
undetectable
3j7za-3l0gA:
undetectable		 3j7zS-3l0gA:
16.50
3j7za-3l0gA:
5.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JQ7_B_DX2B271_1
(PTERIDINE REDUCTASE
1)		 4pys BETA-N-ACETYLHEXOSAM
INIDASE
(Bacteroides
fragilis) 		4 / 8 PHE A 405
ASP A 450
TYR A 413
TRP A 373
 FMT  A 606 (-4.6A)
GOL  A 604 (-3.0A)
None
GOL  A 603 (-3.6A)
 0.93A 3jq7B-4pysA:
undetectable		 3jq7B-4pysA:
19.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JUS_A_ECLA600_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3qm3 FRUCTOSE-BISPHOSPHAT
E ALDOLASE
(Campylobacter
jejuni) 		4 / 8 LEU A 132
GLY A  10
ALA A  92
ILE A  42
 None
FMT  A 356 (-3.6A)
None
None
 0.83A 3jusA-3qm3A:
undetectable		 3jusA-3qm3A:
22.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JUS_A_ECNA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3qm3 FRUCTOSE-BISPHOSPHAT
E ALDOLASE
(Campylobacter
jejuni) 		4 / 8 LEU A 132
GLY A  10
ALA A  92
ILE A  42
 None
FMT  A 356 (-3.6A)
None
None
 0.83A 3jusA-3qm3A:
undetectable		 3jusA-3qm3A:
22.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JX5_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 3ih5 ELECTRON TRANSFER
FLAVOPROTEIN
ALPHA-SUBUNIT
(Bacteroides
thetaiotaomicron) 		4 / 7 GLU A 169
VAL A  17
ARG A 101
VAL A 167
 None
None
FMT  A 218 ( 4.1A)
None
 1.32A 3jx5A-3ih5A:
undetectable
3jx5B-3ih5A:
undetectable		 3jx5A-3ih5A:
19.58
3jx5B-3ih5A:
19.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3JX6_B_H4BB761_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 3ih5 ELECTRON TRANSFER
FLAVOPROTEIN
ALPHA-SUBUNIT
(Bacteroides
thetaiotaomicron) 		4 / 7 GLU A 169
VAL A  17
ARG A 101
VAL A 167
 None
None
FMT  A 218 ( 4.1A)
None
 1.29A 3jx6A-3ih5A:
undetectable
3jx6B-3ih5A:
undetectable		 3jx6A-3ih5A:
20.65
3jx6B-3ih5A:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3K39_A_BCZA1001_0
(NEURAMINIDASE)		 4e4f MANNONATE
DEHYDRATASE
(Pectobacterium
carotovorum) 		5 / 12 ARG A 147
GLU A 341
ARG A 285
ALA A 172
GLU A 170
 None
FMT  A 506 ( 4.1A)
FMT  A 506 (-4.3A)
None
None
 1.48A 3k39A-4e4fA:
undetectable		 3k39A-4e4fA:
22.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3K39_F_BCZF1001_0
(NEURAMINIDASE)		 4e4f MANNONATE
DEHYDRATASE
(Pectobacterium
carotovorum) 		5 / 12 ARG A 147
GLU A 341
ARG A 285
ALA A 172
GLU A 170
 None
FMT  A 506 ( 4.1A)
FMT  A 506 (-4.3A)
None
None
 1.48A 3k39F-4e4fA:
undetectable		 3k39F-4e4fA:
22.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3K39_G_BCZG1001_0
(NEURAMINIDASE)		 4e4f MANNONATE
DEHYDRATASE
(Pectobacterium
carotovorum) 		5 / 12 ARG A 147
GLU A 341
ARG A 285
ALA A 172
GLU A 170
 None
FMT  A 506 ( 4.1A)
FMT  A 506 (-4.3A)
None
None
 1.48A 3k39G-4e4fA:
undetectable		 3k39G-4e4fA:
22.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3K39_H_BCZH1001_0
(NEURAMINIDASE)		 4e4f MANNONATE
DEHYDRATASE
(Pectobacterium
carotovorum) 		5 / 12 ARG A 147
GLU A 341
ARG A 285
ALA A 172
GLU A 170
 None
FMT  A 506 ( 4.1A)
FMT  A 506 (-4.3A)
None
None
 1.48A 3k39H-4e4fA:
undetectable		 3k39H-4e4fA:
22.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3K39_K_BCZK1001_0
(NEURAMINIDASE)		 4e4f MANNONATE
DEHYDRATASE
(Pectobacterium
carotovorum) 		5 / 12 ARG A 147
GLU A 341
ARG A 285
ALA A 172
GLU A 170
 None
FMT  A 506 ( 4.1A)
FMT  A 506 (-4.3A)
None
None
 1.48A 3k39K-4e4fA:
undetectable		 3k39K-4e4fA:
22.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3K39_L_BCZL1001_0
(NEURAMINIDASE)		 4e4f MANNONATE
DEHYDRATASE
(Pectobacterium
carotovorum) 		5 / 12 ARG A 147
GLU A 341
ARG A 285
ALA A 172
GLU A 170
 None
FMT  A 506 ( 4.1A)
FMT  A 506 (-4.3A)
None
None
 1.48A 3k39L-4e4fA:
undetectable		 3k39L-4e4fA:
22.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3K4V_D_ROCD201_1
(HIV-1 PROTEASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ALA A 134
VAL A 259
ILE A 309
GLY A 305
ILE A 261
 None
FMT  A 465 ( 4.3A)
FMT  A 465 (-4.9A)
None
None
 0.99A 3k4vC-3oksA:
undetectable		 3k4vC-3oksA:
12.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KEE_D_30BD500_2
(GENOME POLYPROTEIN)		 3c7o ENDO-1,4-BETA-XYLANA
SE
(Bacillus
subtilis) 		4 / 4 PHE A 296
TYR A  35
VAL A 339
LEU A 328
 FMT  A2062 (-4.3A)
None
None
None
 1.46A 3keeD-3c7oA:
undetectable		 3keeD-3c7oA:
17.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KKZ_B_SAMB302_0
(UNCHARACTERIZED
PROTEIN Q5LES9)		 5w2f EUKARYOTIC
TRANSLATION
INITIATION FACTOR 2D
(Homo
sapiens) 		5 / 12 ARG A 568
GLY A 573
GLY A 557
ALA A 577
ASN A 551
 None
FMT  A 601 ( 4.9A)
None
None
FMT  A 603 (-3.8A)
 1.10A 3kkzB-5w2fA:
undetectable		 3kkzB-5w2fA:
20.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KO0_I_TFPI201_1
(PROTEIN S100-A4)		 9rub RIBULOSE-1,5-BISPHOS
PHATE CARBOXYLASE
(Rhodospirillum
rubrum) 		5 / 9 PHE A 397
GLY A 398
PRO A 403
GLY A 370
ILE A 164
 None
None
None
None
FMT  A 601 ( 3.8A)
 1.15A 3ko0H-9rubA:
undetectable
3ko0I-9rubA:
undetectable		 3ko0H-9rubA:
13.22
3ko0I-9rubA:
13.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KO0_K_TFPK202_1
(PROTEIN S100-A4)		 6b1z GLUTAMATE--TRNA
LIGASE
(Elizabethkingia
anophelis) 		5 / 12 ILE A 486
LEU A 482
ASP A 481
PHE A 439
SER A 447
 None
None
FMT  A 614 (-3.6A)
None
None
 1.19A 3ko0K-6b1zA:
undetectable
3ko0L-6b1zA:
undetectable
3ko0S-6b1zA:
undetectable
3ko0T-6b1zA:
undetectable		 3ko0K-6b1zA:
10.96
3ko0L-6b1zA:
10.96
3ko0S-6b1zA:
10.96
3ko0T-6b1zA:
10.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KO0_N_TFPN201_1
(PROTEIN S100-A4)		 4f0l AMIDOHYDROLASE
(Brucella
abortus) 		5 / 10 GLY A 371
PHE A 320
GLY A 377
ILE A 273
CYH A 296
 None
FMT  A 502 (-4.2A)
None
None
None
 1.36A 3ko0L-4f0lA:
undetectable
3ko0N-4f0lA:
undetectable		 3ko0L-4f0lA:
12.98
3ko0N-4f0lA:
12.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KP2_A_PNNA5001_0
(TRANSCRIPTIONAL
REGULATOR TCAR)		 3o5a PERIPLASMIC NITRATE
REDUCTASE
(Cupriavidus
necator) 		4 / 8 ASN A 358
LEU A 364
SER A 342
ASN A 349
 None
FMT  A 804 (-4.1A)
None
None
 1.13A 3kp2A-3o5aA:
undetectable
3kp2B-3o5aA:
undetectable		 3kp2A-3o5aA:
9.85
3kp2B-3o5aA:
9.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3L2V_A_RLTA397_1
(INTEGRASE)		 1r4p SHIGA-LIKE TOXIN
TYPE II A SUBUNIT
(Escherichia
coli) 		4 / 7 ASP A 195
GLN A 129
GLN A 180
GLU A 177
 None
FMT  A3013 (-4.9A)
None
None
 0.84A 3l2vA-1r4pA:
undetectable		 3l2vA-1r4pA:
21.07
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3LFA_A_1N1A361_1
(MITOGEN-ACTIVATED
PROTEIN KINASE 14)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		5 / 8 VAL A  27
ALA A  50
LYS A  52
GLU A  66
LEU A  95
 6A7  A 401 (-4.7A)
6A7  A 401 (-3.3A)
6A7  A 401 ( 2.9A)
FMT  A 404 ( 4.2A)
None
 0.56A 3lfaA-5idnA:
10.7		 3lfaA-5idnA:
32.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3LSF_B_PZIB800_0
(GLUTAMATE RECEPTOR 2)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 10 PRO A 103
SER A  56
ASP A  98
PRO A 129
GLY A 127
 None
None
None
FMT  A 501 (-4.8A)
FMT  A 501 (-3.4A)
 1.44A 3lsfB-4kv7A:
1.9
3lsfE-4kv7A:
4.0		 3lsfB-4kv7A:
21.58
3lsfE-4kv7A:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3LSF_E_PZIE800_0
(GLUTAMATE RECEPTOR 2)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 10 PRO A 129
GLY A 127
PRO A 103
SER A  56
ASP A  98
 FMT  A 501 (-4.8A)
FMT  A 501 (-3.4A)
None
None
None
 1.48A 3lsfB-4kv7A:
2.3
3lsfE-4kv7A:
4.0		 3lsfB-4kv7A:
21.58
3lsfE-4kv7A:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3LTW_A_HLZA300_1
(ARYLAMINE
N-ACETYLTRANSFERASE
NAT)		 6beg SCAFFOLD PROTEIN D13
(Vaccinia
virus) 		4 / 6 PHE A 433
VAL A 521
THR A 266
PHE A 270
 FMT  A 601 (-4.7A)
None
None
None
 1.39A 3ltwA-6begA:
undetectable		 3ltwA-6begA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3MB5_A_SAMA301_1
(SAM-DEPENDENT
METHYLTRANSFERASE)		 3gjy SPERMIDINE SYNTHASE
(Corynebacterium
glutamicum) 		4 / 4 GLY A  94
GLU A 117
ASP A 144
ASP A 163
 None
FMT  A 315 (-3.6A)
None
None
 0.66A 3mb5A-3gjyA:
13.9		 3mb5A-3gjyA:
21.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)		 6c5b METHYLTRANSFERASE
(Lysobacter
antibioticus) 		5 / 11 LEU A 188
VAL A 166
ALA A 165
PHE A 290
THR A 159
 FMT  A 502 (-4.4A)
None
None
None
SAH  A 501 (-3.0A)
 1.14A 3n23C-6c5bA:
undetectable		 3n23C-6c5bA:
6.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3N2O_C_AG2C1002_1
(BIOSYNTHETIC
ARGININE
DECARBOXYLASE)		 3nnm CURA
(Lyngbya
majuscula) 		4 / 8 LYS A  54
HIS A  99
ASP A 166
LEU A 169
 FMT  A 750 ( 4.8A)
FMT  A 750 (-4.3A)
None
None
 1.07A 3n2oC-3nnmA:
undetectable
3n2oD-3nnmA:
undetectable		 3n2oC-3nnmA:
20.00
3n2oD-3nnmA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NMU_F_SAMF228_0
(FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE
NOP5/NOP56 RELATED
PROTEIN)		 3gjy SPERMIDINE SYNTHASE
(Corynebacterium
glutamicum) 		5 / 12 GLY A  94
GLU A 117
ASP A 144
ALA A 145
ASP A 163
 None
FMT  A 315 (-3.6A)
None
None
None
 0.65A 3nmuA-3gjyA:
undetectable
3nmuF-3gjyA:
9.2		 3nmuA-3gjyA:
21.61
3nmuF-3gjyA:
19.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NNE_A_ACTA601_0
(CHOLINE OXIDASE)		 3wkq NITRITE REDUCTASE
(Geobacillus
thermodenitrific
ans) 		4 / 5 ILE A  49
HIS A  21
VAL A  93
HIS A  95
 None
FMT  A 412 (-3.7A)
None
CU  A 401 (-3.1A)
 1.48A 3nneA-3wkqA:
undetectable		 3nneA-3wkqA:
19.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NNE_B_ACTB601_0
(CHOLINE OXIDASE)		 3wkq NITRITE REDUCTASE
(Geobacillus
thermodenitrific
ans) 		4 / 5 ILE A  49
HIS A  21
VAL A  93
HIS A  95
 None
FMT  A 412 (-3.7A)
None
CU  A 401 (-3.1A)
 1.46A 3nneB-3wkqA:
0.0		 3nneB-3wkqA:
19.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NVK_J_SAMJ228_0
(FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE
NOP5/NOP56 RELATED
PROTEIN)		 3gjy SPERMIDINE SYNTHASE
(Corynebacterium
glutamicum) 		6 / 12 GLY A  94
GLU A 117
ASP A 144
ALA A 145
ASP A 163
VAL A 164
 None
FMT  A 315 (-3.6A)
None
None
None
None
 0.98A 3nvkF-3gjyA:
undetectable
3nvkJ-3gjyA:
12.1		 3nvkF-3gjyA:
21.27
3nvkJ-3gjyA:
19.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NY4_A_SMXA308_1
(BETA-LACTAMASE)		 1k38 BETA-LACTAMASE OXA-2
(Salmonella
enterica) 		6 / 12 SER A  67
SER A 115
ARG A 244
LYS A 205
THR A 206
GLY A 207
 KCX  A  70 ( 2.7A)
FMT  A 401 (-2.4A)
FMT  A 401 (-2.6A)
FMT  A 401 ( 3.8A)
FMT  A 401 (-3.7A)
FMT  A 401 (-3.6A)
 0.74A 3ny4A-1k38A:
18.9		 3ny4A-1k38A:
23.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NY4_A_SMXA308_1
(BETA-LACTAMASE)		 5kzh BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 12 SER A  80
SER A 127
ARG A 260
LYS A 217
GLY A 219
ASP A 223
 FMT  A 301 (-2.5A)
FMT  A 301 (-3.3A)
None
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
 0.94A 3ny4A-5kzhA:
19.5		 3ny4A-5kzhA:
21.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NY4_A_SMXA308_1
(BETA-LACTAMASE)		 5kzh BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 12 SER A  80
SER A 127
ARG A 260
LYS A 217
GLY A 219
GLY A 221
 FMT  A 301 (-2.5A)
FMT  A 301 (-3.3A)
None
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
 0.88A 3ny4A-5kzhA:
19.5		 3ny4A-5kzhA:
21.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OGP_A_017A200_1
(FIV PROTEASE)		 3lp6 PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE
CATALYTIC SUBUNIT
(Mycobacterium
tuberculosis) 		5 / 9 GLY A  71
ALA A  70
ASP A  19
GLY A 122
ILE A 121
 FMT  A 175 (-4.1A)
FMT  A 175 ( 4.3A)
FMT  A 175 (-3.5A)
None
None
 0.90A 3ogpA-3lp6A:
undetectable		 3ogpA-3lp6A:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OGP_A_017A200_1
(FIV PROTEASE)		 3opq PHOSPHORIBOSYLAMINOI
MIDAZOLE
CARBOXYLASE,CATALYTI
C SUBUNIT
(Francisella
tularensis) 		5 / 9 GLY A  66
ALA A  65
ASP A  14
GLY A 117
ILE A 116
 PO4  A 164 (-3.7A)
PO4  A 164 (-3.3A)
PO4  A 164 (-2.8A)
FMT  A 166 (-3.3A)
None
 0.91A 3ogpA-3opqA:
undetectable		 3ogpA-3opqA:
21.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OGP_B_017B200_2
(FIV PROTEASE)		 3lp6 PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE
CATALYTIC SUBUNIT
(Mycobacterium
tuberculosis) 		5 / 9 GLY A  71
ALA A  70
ASP A  19
GLY A 122
ILE A 121
 FMT  A 175 (-4.1A)
FMT  A 175 ( 4.3A)
FMT  A 175 (-3.5A)
None
None
 1.03A 3ogpB-3lp6A:
undetectable		 3ogpB-3lp6A:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OGQ_A_AB1A200_2
(FIV PROTEASE)		 3lp6 PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE
CATALYTIC SUBUNIT
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  71
ALA A  70
ASP A  19
GLY A 122
ILE A 121
 FMT  A 175 (-4.1A)
FMT  A 175 ( 4.3A)
FMT  A 175 (-3.5A)
None
None
 0.94A 3ogqB-3lp6A:
undetectable		 3ogqB-3lp6A:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OGQ_A_AB1A200_2
(FIV PROTEASE)		 3opq PHOSPHORIBOSYLAMINOI
MIDAZOLE
CARBOXYLASE,CATALYTI
C SUBUNIT
(Francisella
tularensis) 		5 / 12 GLY A  66
ALA A  65
ASP A  14
GLY A 117
ILE A 116
 PO4  A 164 (-3.7A)
PO4  A 164 (-3.3A)
PO4  A 164 (-2.8A)
FMT  A 166 (-3.3A)
None
 0.96A 3ogqB-3opqA:
undetectable		 3ogqB-3opqA:
21.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OU6_B_SAMB300_1
(SAM-DEPENDENT
METHYLTRANSFERASE)		 3ed5 YFNB
(Bacillus
subtilis) 		3 / 3 TYR A 160
ASP A 186
ASP A  13
 None
FMT  A 237 ( 4.8A)
None
 0.83A 3ou6B-3ed5A:
undetectable		 3ou6B-3ed5A:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OXV_C_478C200_2
(HIV-1 PROTEASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 11 ALA A 134
VAL A 259
ILE A 309
PRO A 285
ILE A 261
 None
FMT  A 465 ( 4.3A)
FMT  A 465 (-4.9A)
None
None
 1.05A 3oxvD-3oksA:
undetectable		 3oxvD-3oksA:
12.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OXW_B_017B200_2
(HIV-1 PROTEASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 10 ALA A 134
VAL A 259
ILE A 309
GLY A 305
ILE A 261
 None
FMT  A 465 ( 4.3A)
FMT  A 465 (-4.9A)
None
None
 1.06A 3oxwB-3oksA:
undetectable		 3oxwB-3oksA:
12.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OXW_B_017B200_2
(HIV-1 PROTEASE)		 3oks 4-AMINOBUTYRATE
TRANSAMINASE
(Mycolicibacteriu
m
smegmatis) 		5 / 10 ALA A 134
VAL A 259
ILE A 309
PRO A 285
ILE A 261
 None
FMT  A 465 ( 4.3A)
FMT  A 465 (-4.9A)
None
None
 1.02A 3oxwB-3oksA:
undetectable		 3oxwB-3oksA:
12.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3R2J_C_NIOC311_1
(ALPHA/BETA-HYDROLASE
-LIKE PROTEIN)		 1nf9 PHENAZINE
BIOSYNTHESIS PROTEIN
PHZD
(Pseudomonas
aeruginosa) 		5 / 12 ASP A  38
PHE A  43
TRP A  94
LYS A 122
TYR A 125
 None
None
FMT  A 210 ( 4.4A)
None
None
 0.84A 3r2jC-1nf9A:
20.2		 3r2jC-1nf9A:
22.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3R9C_A_ECLA451_1
(CYTOCHROME P450
164A2)		 6ccz SERINE
HYDROXYMETHYLTRANSFE
RASE
(Medicago
truncatula) 		5 / 10 LEU A 296
ALA A 291
THR A 314
VAL A 312
VAL A 309
 None
LLP  A 318 (-3.3A)
FMT  A 613 ( 4.6A)
None
None
 1.45A 3r9cA-6cczA:
undetectable		 3r9cA-6cczA:
11.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3RGF_A_BAXA465_1
(CYCLIN-DEPENDENT
KINASE 8)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		10 / 12 VAL A  35
ALA A  50
GLU A  66
LEU A  70
ILE A  79
PHE A  97
TYR A  99
ALA A 100
LEU A 142
HIS A 149
 6A7  A 401 ( 4.5A)
6A7  A 401 (-3.3A)
FMT  A 404 ( 4.2A)
None
6A7  A 401 (-4.2A)
6A7  A 401 (-3.8A)
6A7  A 401 (-4.9A)
6A7  A 401 (-3.7A)
None
FMT  A 403 (-4.6A)
 0.70A 3rgfA-5idnA:
45.0		 3rgfA-5idnA:
91.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3RGF_A_BAXA465_1
(CYCLIN-DEPENDENT
KINASE 8)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		10 / 12 VAL A  35
ALA A  50
LEU A  70
ILE A  79
PHE A  97
TYR A  99
ALA A 100
LEU A 142
HIS A 149
ALA A 172
 6A7  A 401 ( 4.5A)
6A7  A 401 (-3.3A)
None
6A7  A 401 (-4.2A)
6A7  A 401 (-3.8A)
6A7  A 401 (-4.9A)
6A7  A 401 (-3.7A)
None
FMT  A 403 (-4.6A)
6A7  A 401 ( 4.1A)
 0.53A 3rgfA-5idnA:
45.0		 3rgfA-5idnA:
91.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3S3M_A_DLUA398_1
(PFV INTEGRASE)		 2woc ADP-RIBOSYL-[DINITRO
GEN REDUCTASE]
GLYCOHYDROLASE
(Rhodospirillum
rubrum) 		4 / 8 ASP A  61
ASP A  60
GLY A  99
GLN A  57
 FMT  A 402 ( 4.1A)
FMT  A 402 ( 2.7A)
None
None
 0.87A 3s3mA-2wocA:
undetectable		 3s3mA-2wocA:
20.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3S3N_A_DLUA398_1
(PFV INTEGRASE)		 2woc ADP-RIBOSYL-[DINITRO
GEN REDUCTASE]
GLYCOHYDROLASE
(Rhodospirillum
rubrum) 		4 / 8 ASP A  61
ASP A  60
GLY A  99
GLN A  57
 FMT  A 402 ( 4.1A)
FMT  A 402 ( 2.7A)
None
None
 0.93A 3s3nA-2wocA:
undetectable		 3s3nA-2wocA:
20.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3S79_A_ASDA601_1
(CYTOCHROME P450 19A1)		 4qc6 BIFUNCTIONAL AAC/APH
(Staphylococcus
warneri) 		5 / 12 ILE A  70
ILE A 112
VAL A  30
LEU A  25
MET A  21
 None
30N  A 202 (-4.9A)
None
FMT  A 203 ( 4.4A)
None
 0.98A 3s79A-4qc6A:
undetectable		 3s79A-4qc6A:
17.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SG9_B_KANB305_1
(APH(2'')-ID)		 4c6o CAD PROTEIN
(Homo
sapiens) 		4 / 8 ASP A1686
SER A1613
HIS A1471
GLU A1592
 ZN  A2822 (-2.6A)
FMT  A2827 (-3.8A)
ZN  A2822 ( 3.2A)
None
 1.09A 3sg9B-4c6oA:
undetectable		 3sg9B-4c6oA:
19.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SH8_A_CEDA1_1
(BETA-LACTAMASE)		 1k38 BETA-LACTAMASE OXA-2
(Salmonella
enterica) 		7 / 12 ALA A  66
SER A  67
SER A 115
LYS A 205
THR A 206
GLY A 207
ARG A 244
 None
KCX  A  70 ( 2.7A)
FMT  A 401 (-2.4A)
FMT  A 401 ( 3.8A)
FMT  A 401 (-3.7A)
FMT  A 401 (-3.6A)
FMT  A 401 (-2.6A)
 0.62A 3sh8A-1k38A:
19.4		 3sh8A-1k38A:
24.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SH8_A_CEDA1_1
(BETA-LACTAMASE)		 5kzh BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 12 ALA A  79
SER A  80
SER A 127
LYS A 217
GLY A 219
ARG A 260
 FMT  A 301 (-3.2A)
FMT  A 301 (-2.5A)
FMT  A 301 (-3.3A)
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
 0.60A 3sh8A-5kzhA:
19.8		 3sh8A-5kzhA:
23.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SH8_B_CEDB1_1
(BETA-LACTAMASE)		 1k38 BETA-LACTAMASE OXA-2
(Salmonella
enterica) 		6 / 12 ALA A  66
SER A  67
SER A 115
LYS A 205
GLY A 207
ARG A 244
 None
KCX  A  70 ( 2.7A)
FMT  A 401 (-2.4A)
FMT  A 401 ( 3.8A)
FMT  A 401 (-3.6A)
FMT  A 401 (-2.6A)
 0.63A 3sh8B-1k38A:
19.5		 3sh8B-1k38A:
24.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SH8_B_CEDB1_1
(BETA-LACTAMASE)		 5kzh BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 12 ALA A  79
SER A  80
SER A 127
LYS A 217
GLY A 219
ARG A 260
 FMT  A 301 (-3.2A)
FMT  A 301 (-2.5A)
FMT  A 301 (-3.3A)
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
 0.57A 3sh8B-5kzhA:
19.8		 3sh8B-5kzhA:
23.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SJ4_X_DXCX75_0
(CYTOCHROME C7)		 4pzl ADENYLATE KINASE
(Francisella
tularensis) 		5 / 9 ILE A  20
LEU A  82
LYS A 197
ILE A 196
GLY A   7
 None
None
FMT  A 302 ( 4.6A)
None
None
 0.97A 3sj4X-4pzlA:
undetectable		 3sj4X-4pzlA:
14.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SO9_A_017A100_2
(HIV-1 PROTEASE)		 3pei CYTOSOL
AMINOPEPTIDASE
(Francisella
tularensis) 		6 / 12 LEU A 470
ASP A  78
GLY A 159
ILE A 158
THR A 283
VAL A 467
 None
FMT  A 501 ( 4.8A)
None
None
None
None
 1.43A 3so9B-3peiA:
undetectable		 3so9B-3peiA:
11.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SUE_D_SUED1201_2
(NS3 PROTEASE, NS4A
PROTEIN)		 3nnm CURA
(Lyngbya
majuscula) 		3 / 3 TYR A 225
LEU A   9
LYS A  10
 FMT  A 754 (-4.2A)
None
None
 0.78A 3sueD-3nnmA:
0.0		 3sueD-3nnmA:
19.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3T3C_A_017A201_2
(HIV-1 PROTEASE)		 6c5b METHYLTRANSFERASE
(Lysobacter
antibioticus) 		5 / 10 ASP A 180
VAL A 178
ILE A 192
PRO A 174
VAL A 243
 FMT  A 502 (-2.6A)
None
None
None
None
 0.85A 3t3cB-6c5bA:
undetectable		 3t3cB-6c5bA:
21.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TGV_D_BEZD1_0
(HEME-BINDING PROTEIN
HUTZ)		 3c2b TRANSCRIPTIONAL
REGULATOR, TETR
FAMILY
(Agrobacterium
fabrum) 		4 / 6 ARG A 134
TYR A 163
PHE A  94
LEU A  98
 FMT  A 302 (-3.3A)
FMT  A 302 ( 4.2A)
None
None
 1.36A 3tgvD-3c2bA:
undetectable		 3tgvD-3c2bA:
20.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TGV_D_BEZD1_0
(HEME-BINDING PROTEIN
HUTZ)		 4az1 TYROSINE SPECIFIC
PROTEIN PHOSPHATASE
(Trypanosoma
cruzi) 		4 / 6 GLN A 188
PHE A 104
PRO A  96
LEU A 105
 None
FMT  A1306 ( 4.8A)
FMT  A1306 (-3.8A)
None
 1.26A 3tgvD-4az1A:
undetectable		 3tgvD-4az1A:
18.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TIC_A_ZMRA1002_2
(NEURAMINIDASE)		 4jbb PUTATIVE GLUTATHIONE
S-TRANSFERASE
(Klebsiella
pneumoniae) 		4 / 5 LEU A 134
ARG A 177
ARG A 120
ARG A 117
 None
FMT  A 302 (-2.9A)
None
None
 1.19A 3ticA-4jbbA:
undetectable		 3ticA-4jbbA:
18.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TL9_A_ROCA401_4
(PROTEASE)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		4 / 4 ASP A 464
ASP A 463
GLY A 199
THR A  79
 None
None
FMT  A1802 (-3.1A)
None
 1.36A 3tl9B-2c4mA:
undetectable		 3tl9B-2c4mA:
10.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3U6T_A_KANA4699_1
(RIBOSOME
INACTIVATING PROTEIN)		 1r4p SHIGA-LIKE TOXIN
TYPE II A SUBUNIT
(Escherichia
coli) 		5 / 10 TYR A  77
TYR A 114
ALA A 166
GLU A 167
ARG A 170
 FMT  A3015 (-4.7A)
FMT  A3015 ( 4.1A)
FMT  A3015 ( 4.9A)
None
None
 0.77A 3u6tA-1r4pA:
23.2		 3u6tA-1r4pA:
25.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3U7S_A_017A202_2
(POL POLYPROTEIN)		 3lp6 PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE
CATALYTIC SUBUNIT
(Mycobacterium
tuberculosis) 		5 / 9 GLY A  71
ALA A  70
ASP A  19
GLY A 122
ILE A 121
 FMT  A 175 (-4.1A)
FMT  A 175 ( 4.3A)
FMT  A 175 (-3.5A)
None
None
 1.04A 3u7sB-3lp6A:
undetectable		 3u7sB-3lp6A:
19.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3U7S_A_017A202_2
(POL POLYPROTEIN)		 3opq PHOSPHORIBOSYLAMINOI
MIDAZOLE
CARBOXYLASE,CATALYTI
C SUBUNIT
(Francisella
tularensis) 		5 / 9 GLY A  66
ALA A  65
ASP A  14
GLY A 117
ILE A 116
 PO4  A 164 (-3.7A)
PO4  A 164 (-3.3A)
PO4  A 164 (-2.8A)
FMT  A 166 (-3.3A)
None
 1.05A 3u7sB-3opqA:
undetectable		 3u7sB-3opqA:
19.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3U9F_D_CLMD221_0
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 4uug AMINE TRANSAMINASE
(Aspergillus
fumigatus) 		5 / 12 THR A 238
SER A 241
VAL A 245
ALA A   2
HIS A 309
 PXG  A 401 (-3.5A)
None
None
None
FMT  A 403 (-3.8A)
 1.46A 3u9fD-4uugA:
undetectable
3u9fE-4uugA:
undetectable		 3u9fD-4uugA:
18.79
3u9fE-4uugA:
18.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3U9F_G_CLMG221_0
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 4uug AMINE TRANSAMINASE
(Aspergillus
fumigatus) 		5 / 12 THR A 238
SER A 241
VAL A 245
ALA A   2
HIS A 309
 PXG  A 401 (-3.5A)
None
None
None
FMT  A 403 (-3.8A)
 1.42A 3u9fG-4uugA:
undetectable
3u9fH-4uugA:
undetectable		 3u9fG-4uugA:
18.79
3u9fH-4uugA:
18.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UCB_A_017A201_1
(PROTEASE)		 3lp6 PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE
CATALYTIC SUBUNIT
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  71
ALA A  70
ASP A  19
GLY A 122
ILE A 121
 FMT  A 175 (-4.1A)
FMT  A 175 ( 4.3A)
FMT  A 175 (-3.5A)
None
None
 0.98A 3ucbA-3lp6A:
undetectable		 3ucbA-3lp6A:
20.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UCB_A_017A201_1
(PROTEASE)		 3opq PHOSPHORIBOSYLAMINOI
MIDAZOLE
CARBOXYLASE,CATALYTI
C SUBUNIT
(Francisella
tularensis) 		5 / 12 GLY A  66
ALA A  65
ASP A  14
GLY A 117
ILE A 116
 PO4  A 164 (-3.7A)
PO4  A 164 (-3.3A)
PO4  A 164 (-2.8A)
FMT  A 166 (-3.3A)
None
 1.00A 3ucbA-3opqA:
undetectable		 3ucbA-3opqA:
21.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UCJ_A_AZMA229_1
(CARBONIC ANHYDRASE)		 1qwr MANNOSE-6-PHOSPHATE
ISOMERASE
(Bacillus
subtilis) 		5 / 10 ASP A  88
VAL A 181
GLY A 178
ALA A 179
ALA A 127
 None
None
FMT  A 606 ( 4.6A)
None
None
 1.21A 3ucjA-1qwrA:
undetectable		 3ucjA-1qwrA:
20.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UCJ_A_AZMA229_2
(CARBONIC ANHYDRASE)		 5swc CARBONIC ANHYDRASE
(Synechocystis
sp.
PCC
6803) 		3 / 3 GLN A  30
PHE A  58
TYR A  83
 FMT  A 304 (-3.8A)
FMT  A 304 (-4.6A)
FMT  A 304 (-3.4A)
 0.26A 3ucjB-5swcA:
22.7		 3ucjB-5swcA:
28.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UCJ_B_AZMB229_1
(CARBONIC ANHYDRASE)		 5swc CARBONIC ANHYDRASE
(Synechocystis
sp.
PCC
6803) 		3 / 3 GLN A  30
PHE A  58
TYR A  83
 FMT  A 304 (-3.8A)
FMT  A 304 (-4.6A)
FMT  A 304 (-3.4A)
 0.25A 3ucjA-5swcA:
22.0		 3ucjA-5swcA:
28.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UCJ_B_AZMB229_2
(CARBONIC ANHYDRASE)		 1qwr MANNOSE-6-PHOSPHATE
ISOMERASE
(Bacillus
subtilis) 		5 / 10 ASP A  88
VAL A 181
GLY A 178
ALA A 179
ALA A 127
 None
None
FMT  A 606 ( 4.6A)
None
None
 1.22A 3ucjB-1qwrA:
undetectable		 3ucjB-1qwrA:
20.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UFN_A_ROCA401_2
(HIV-1 PROTEASE)		 4rzm EPOXIDE HYDROLASE
LASB
(Streptomyces
lasaliensis) 		4 / 7 ARG A  17
VAL A 102
GLY A 104
ILE A 106
 None
None
FMT  A 303 ( 4.1A)
None
 0.82A 3ufnB-4rzmA:
undetectable		 3ufnB-4rzmA:
17.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UJ6_A_SAMA300_0
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE)		 4pys BETA-N-ACETYLHEXOSAM
INIDASE
(Bacteroides
fragilis) 		5 / 12 ILE A  23
ILE A 136
ILE A  79
ARG A 119
LEU A  39
 FMT  A 609 (-4.5A)
None
None
None
None
 0.98A 3uj6A-4pysA:
undetectable		 3uj6A-4pysA:
19.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UJ7_A_SAMA301_0
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE)		 3nnm CURA
(Lyngbya
majuscula) 		5 / 12 LEU A 112
ILE A  61
ILE A  58
ARG A 259
HIS A 115
 FMT  A 500 ( 4.8A)
None
None
None
None
 1.36A 3uj7A-3nnmA:
undetectable		 3uj7A-3nnmA:
22.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3V3N_B_MIYB2001_1
(TETX2 PROTEIN)		 4qbu ZMAA
(Bacillus
cereus) 		4 / 8 ARG A 217
GLY A 350
GLY A 101
MET A 229
 FMT  A 500 (-2.9A)
None
None
None
 0.66A 3v3nB-4qbuA:
undetectable		 3v3nB-4qbuA:
20.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3V3N_C_MIYC2001_1
(TETX2 PROTEIN)		 4qbu ZMAA
(Bacillus
cereus) 		4 / 8 ARG A 217
GLY A 350
GLY A 101
MET A 229
 FMT  A 500 (-2.9A)
None
None
None
 0.67A 3v3nC-4qbuA:
undetectable		 3v3nC-4qbuA:
20.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3V3O_B_T1CB405_1
(TETX2 PROTEIN)		 2yn2 UNCHARACTERIZED
PROTEIN YNL108C
(Saccharomyces
cerevisiae) 		5 / 12 GLN A  43
HIS A  39
GLY A  40
GLY A 251
GLU A 249
 None
None
None
FMT  A1264 ( 3.7A)
None
 1.14A 3v3oB-2yn2A:
undetectable		 3v3oB-2yn2A:
22.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3V4T_A_ACTA503_0
(UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE)		 5hjr NEUTRAL
ALPHA-GLUCOSIDASE AB
(Mus
musculus) 		3 / 3 ARG A  51
GLU A 294
THR A 293
 None
None
FMT  A1007 (-3.5A)
 0.92A 3v4tA-5hjrA:
undetectable		 3v4tA-5hjrA:
19.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3V4T_A_ACTA505_0
(UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE)		 3c7o ENDO-1,4-BETA-XYLANA
SE
(Bacillus
subtilis) 		3 / 3 THR A 387
ASN A 478
GLU A 372
 None
FMT  A2055 ( 4.4A)
None
 0.66A 3v4tA-3c7oA:
undetectable
3v4tC-3c7oA:
undetectable		 3v4tA-3c7oA:
21.79
3v4tC-3c7oA:
21.79
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3V4T_E_ACTE502_0
(UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE)		 5u4h UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE
(Acinetobacter
baumannii) 		3 / 3 LYS A  22
ARG A 332
LEU A 371
 FMT  A 507 ( 2.7A)
FMT  A 507 (-3.5A)
FMT  A 507 ( 4.9A)
 1.42A 3v4tE-5u4hA:
64.0		 3v4tE-5u4hA:
58.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3V4T_H_ACTH503_0
(UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE)		 3ius UNCHARACTERIZED
CONSERVED PROTEIN
(Ruegeria
pomeroyi) 		5 / 7 ALA A  40
ILE A  41
ARG A  19
HIS A  10
GLY A  11
 None
None
None
None
FMT  A 285 ( 4.0A)
 1.45A 3v4tH-3iusA:
undetectable		 3v4tH-3iusA:
22.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3V8V_A_SAMA801_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE L)		 4hcj THIJ/PFPI DOMAIN
PROTEIN
(Brachyspira
murdochii) 		5 / 12 ILE A  76
MET A  11
GLY A  74
SER A 106
VAL A  37
 None
None
None
None
FMT  A 205 (-4.5A)
 1.16A 3v8vA-4hcjA:
3.6		 3v8vA-4hcjA:
12.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3V8V_A_SAMA801_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE L)		 5gzt CHITINASE
(Paenibacillus
sp.
FPU-7) 		5 / 12 THR B 975
ASP B1015
VAL B 943
PRO B 980
LEU B 951
 FMT  B4008 (-4.4A)
None
None
None
None
 1.13A 3v8vA-5gztB:
undetectable		 3v8vA-5gztB:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3V8V_A_SAMA802_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE L)		 2igt SAM DEPENDENT
METHYLTRANSFERASE
(Agrobacterium
fabrum) 		6 / 9 PHE A 140
TYR A 142
ASP A 161
SER A 163
ASP A 190
PRO A 213
 SAM  A1001 (-4.4A)
FMT  A1013 ( 4.7A)
SAM  A1001 (-2.9A)
ACY  A1008 ( 2.6A)
SAM  A1001 (-3.7A)
SAM  A1001 (-3.2A)
 0.63A 3v8vA-2igtA:
20.1		 3v8vA-2igtA:
18.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3V8V_B_SAMB802_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE L)		 2igt SAM DEPENDENT
METHYLTRANSFERASE
(Agrobacterium
fabrum) 		6 / 12 PHE A 140
TYR A 142
SER A 163
ASP A 190
ASP A 211
PRO A 213
 SAM  A1001 (-4.4A)
FMT  A1013 ( 4.7A)
ACY  A1008 ( 2.6A)
SAM  A1001 (-3.7A)
SAM  A1001 (-2.8A)
SAM  A1001 (-3.2A)
 0.76A 3v8vB-2igtA:
20.6		 3v8vB-2igtA:
18.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3VLN_A_ASCA904_0
(GLUTATHIONE
S-TRANSFERASE
OMEGA-1)		 5o84 GLUTATHIONE
S-TRANSFERASE U23
(Arabidopsis
thaliana) 		4 / 6 ARG A  18
PRO A  55
GLU A  66
SER A  67
 FMT  A 301 ( 4.8A)
FMT  A 301 (-4.4A)
FMT  A 301 (-4.2A)
FMT  A 301 (-2.6A)
 0.48A 3vlnA-5o84A:
22.9		 3vlnA-5o84A:
26.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3VRM_A_VD3A502_1
(VITAMIN D(3)
25-HYDROXYLASE)		 3fz4 PUTATIVE ARSENATE
REDUCTASE
(Streptococcus
mutans) 		5 / 12 ILE A  92
LEU A  51
LEU A  96
ILE A 103
LEU A  46
 None
None
None
FMT  A 205 (-4.6A)
None
 1.01A 3vrmA-3fz4A:
undetectable		 3vrmA-3fz4A:
17.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3VYW_A_SAMA501_1
(MNMC2)		 2yn2 UNCHARACTERIZED
PROTEIN YNL108C
(Saccharomyces
cerevisiae) 		4 / 6 GLU A  92
ASP A  31
ASP A 255
ASN A  16
 FMT  A1264 (-3.2A)
None
None
None
 1.00A 3vywA-2yn2A:
undetectable		 3vywA-2yn2A:
22.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3VYW_B_SAMB401_0
(MNMC2)		 3o5a PERIPLASMIC NITRATE
REDUCTASE
(Cupriavidus
necator) 		5 / 12 HIS A 151
GLY A 120
ASN A 457
ALA A 132
PHE A 397
 MGD  A1803 ( 4.6A)
None
None
None
FMT  A 803 (-3.6A)
 0.72A 3vywB-3o5aA:
2.9		 3vywB-3o5aA:
16.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3VYW_C_SAMC401_0
(MNMC2)		 3o5a PERIPLASMIC NITRATE
REDUCTASE
(Cupriavidus
necator) 		5 / 12 HIS A 151
GLY A 120
ASN A 457
ALA A 132
PHE A 397
 MGD  A1803 ( 4.6A)
None
None
None
FMT  A 803 (-3.6A)
 0.71A 3vywC-3o5aA:
2.7		 3vywC-3o5aA:
16.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3VYW_D_SAMD401_0
(MNMC2)		 3o5a PERIPLASMIC NITRATE
REDUCTASE
(Cupriavidus
necator) 		5 / 12 HIS A 151
GLY A 120
ASN A 457
ALA A 132
PHE A 397
 MGD  A1803 ( 4.6A)
None
None
None
FMT  A 803 (-3.6A)
 0.70A 3vywD-3o5aA:
undetectable		 3vywD-3o5aA:
16.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3VYW_D_SAMD401_1
(MNMC2)		 2yn2 UNCHARACTERIZED
PROTEIN YNL108C
(Saccharomyces
cerevisiae) 		4 / 5 GLU A  92
ASP A  31
ASP A 255
ASN A  16
 FMT  A1264 (-3.2A)
None
None
None
 1.02A 3vywD-2yn2A:
undetectable		 3vywD-2yn2A:
22.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W37_A_ACRA1001_1
(ALPHA-GLUCOSIDASE)		 5hjr NEUTRAL
ALPHA-GLUCOSIDASE AB
(Mus
musculus) 		5 / 12 ASP A 305
TRP A 423
ASP A 640
PHE A 674
HIS A 700
 None
5GF  A1021 (-3.1A)
5GF  A1021 (-2.6A)
None
FMT  A1020 (-3.9A)
 1.46A 3w37A-5hjrA:
41.2		 3w37A-5hjrA:
29.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W67_A_VIVA301_0
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)		 1r4p SHIGA-LIKE TOXIN
TYPE II A SUBUNIT
(Escherichia
coli) 		5 / 11 SER A 134
LEU A 135
SER A 138
VAL A 164
PHE A 161
 FMT  A3013 (-2.6A)
None
None
None
None
 1.09A 3w67A-1r4pA:
undetectable		 3w67A-1r4pA:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W67_C_VIVC301_0
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)		 3ne8 N-ACETYLMURAMOYL-L-A
LANINE AMIDASE
(Bartonella
henselae) 		5 / 12 ILE A 339
TRP A 383
ALA A 392
ILE A 256
LEU A 184
 None
None
FMT  A 411 ( 3.9A)
None
None
 1.06A 3w67C-3ne8A:
undetectable		 3w67C-3ne8A:
25.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W68_A_VIVA301_0
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)		 1r4p SHIGA-LIKE TOXIN
TYPE II A SUBUNIT
(Escherichia
coli) 		5 / 12 SER A 134
LEU A 135
SER A 138
VAL A 164
PHE A 161
 FMT  A3013 (-2.6A)
None
None
None
None
 1.18A 3w68A-1r4pA:
undetectable		 3w68A-1r4pA:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W9T_B_W9TB502_1
(HEMOLYTIC LECTIN
CEL-III)		 3ju1 ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN
(Shewanella
oneidensis) 		4 / 6 ASP A 165
GLY A 133
LEU A 162
GLU A 109
 None
None
None
FMT  A 403 ( 3.9A)
 1.03A 3w9tB-3ju1A:
undetectable		 3w9tB-3ju1A:
18.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W9T_B_W9TB502_1
(HEMOLYTIC LECTIN
CEL-III)		 3ll7 PUTATIVE
METHYLTRANSFERASE
(Porphyromonas
gingivalis) 		4 / 6 ASP A  96
GLY A 102
LEU A 108
TYR A 165
 None
FMT  A 503 (-3.8A)
None
None
 1.11A 3w9tB-3ll7A:
undetectable		 3w9tB-3ll7A:
22.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W9T_D_W9TD507_1
(HEMOLYTIC LECTIN
CEL-III)		 3ll7 PUTATIVE
METHYLTRANSFERASE
(Porphyromonas
gingivalis) 		4 / 5 ASP A  96
GLY A 102
TYR A 165
ASP A 167
 None
FMT  A 503 (-3.8A)
None
EDO  A 507 (-4.1A)
 1.41A 3w9tD-3ll7A:
undetectable		 3w9tD-3ll7A:
22.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W9T_E_W9TE502_1
(HEMOLYTIC LECTIN
CEL-III)		 3ll7 PUTATIVE
METHYLTRANSFERASE
(Porphyromonas
gingivalis) 		4 / 6 ASP A  96
GLY A 102
LEU A 108
TYR A 165
 None
FMT  A 503 (-3.8A)
None
None
 1.11A 3w9tE-3ll7A:
undetectable		 3w9tE-3ll7A:
22.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W9T_E_W9TE506_1
(HEMOLYTIC LECTIN
CEL-III)		 2cjt UNC-13 HOMOLOG A
(Rattus
norvegicus) 		4 / 6 THR A  22
ASN A  66
GLY A  68
ASP A  72
 None
FMT  A1138 (-3.8A)
FMT  A1137 ( 3.1A)
EDO  A1134 (-2.9A)
 1.18A 3w9tE-2cjtA:
undetectable		 3w9tE-2cjtA:
14.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W9T_F_W9TF503_1
(HEMOLYTIC LECTIN
CEL-III)		 3ll7 PUTATIVE
METHYLTRANSFERASE
(Porphyromonas
gingivalis) 		4 / 6 ASP A  96
GLY A 102
LEU A 108
TYR A 165
 None
FMT  A 503 (-3.8A)
None
None
 1.10A 3w9tF-3ll7A:
undetectable		 3w9tF-3ll7A:
22.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WEL_A_ACRA1001_1
(ALPHA-GLUCOSIDASE)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		5 / 12 ALA A 267
PHE A 263
ILE A 170
ASP A 192
ARG A 207
 None
None
None
None
FMT  A1795 ( 3.8A)
 1.46A 3welA-2c4mA:
undetectable		 3welA-2c4mA:
22.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WEN_A_ACRA1001_1
(ALPHA-GLUCOSIDASE)		 5hjr NEUTRAL
ALPHA-GLUCOSIDASE AB
(Mus
musculus) 		5 / 12 ASP A 305
TRP A 423
ASP A 640
PHE A 674
HIS A 700
 None
5GF  A1021 (-3.1A)
5GF  A1021 (-2.6A)
None
FMT  A1020 (-3.9A)
 1.44A 3wenA-5hjrA:
40.9		 3wenA-5hjrA:
29.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WZE_A_BAXA1201_2
(VASCULAR ENDOTHELIAL
GROWTH FACTOR
RECEPTOR 2)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		4 / 8 VAL A  78
LEU A 158
ILE A 171
ASP A 173
 None
6A7  A 401 (-4.8A)
None
FMT  A 403 ( 3.3A)
 0.70A 3wzeA-5idnA:
13.1		 3wzeA-5idnA:
25.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ZJQ_A_NCAA300_0
(PROTOGLOBIN)		 3lag UNCHARACTERIZED
PROTEIN RPA4178
(Rhodopseudomonas
palustris) 		4 / 7 TRP A  21
TYR A  38
VAL A  40
VAL A  74
 None
FMT  A 100 (-4.4A)
None
None
 0.97A 3zjqA-3lagA:
undetectable		 3zjqA-3lagA:
21.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ZJQ_A_NCAA300_0
(PROTOGLOBIN)		 3zh0 PROTOGLOBIN
(Methanosarcina
acetivorans) 		6 / 7 TYR A  61
VAL A  64
PHE A  74
VAL A  89
PHE A  93
ILE A 149
 FMT  A 201 (-4.2A)
None
HEM  A 200 (-3.6A)
HEM  A 200 (-4.4A)
FMT  A 201 ( 4.3A)
HEM  A 200 (-4.3A)
 0.63A 3zjqA-3zh0A:
29.3		 3zjqA-3zh0A:
90.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ZJQ_B_NCAB300_0
(PROTOGLOBIN)		 3lag UNCHARACTERIZED
PROTEIN RPA4178
(Rhodopseudomonas
palustris) 		4 / 7 TRP A  21
TYR A  38
VAL A  40
VAL A  74
 None
FMT  A 100 (-4.4A)
None
None
 0.97A 3zjqB-3lagA:
undetectable		 3zjqB-3lagA:
21.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ZJQ_B_NCAB300_0
(PROTOGLOBIN)		 3zh0 PROTOGLOBIN
(Methanosarcina
acetivorans) 		6 / 7 TYR A  61
VAL A  64
PHE A  74
VAL A  89
PHE A  93
ILE A 149
 FMT  A 201 (-4.2A)
None
HEM  A 200 (-3.6A)
HEM  A 200 (-4.4A)
FMT  A 201 ( 4.3A)
HEM  A 200 (-4.3A)
 0.62A 3zjqB-3zh0A:
29.1		 3zjqB-3zh0A:
90.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ZOS_A_0LIA1000_1
(EPITHELIAL DISCOIDIN
DOMAIN-CONTAINING
RECEPTOR 1)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		7 / 12 ALA A  50
LYS A  52
LEU A 142
HIS A 149
ARG A 150
LEU A 158
ALA A 172
 6A7  A 401 (-3.3A)
6A7  A 401 ( 2.9A)
None
FMT  A 403 (-4.6A)
None
6A7  A 401 (-4.8A)
6A7  A 401 ( 4.1A)
 0.67A 3zosA-5idnA:
20.5		 3zosA-5idnA:
26.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ZOS_B_0LIB1000_1
(EPITHELIAL DISCOIDIN
DOMAIN-CONTAINING
RECEPTOR 1)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		7 / 12 ALA A  50
LYS A  52
GLU A  66
ILE A  79
LEU A 142
HIS A 149
ARG A 150
 6A7  A 401 (-3.3A)
6A7  A 401 ( 2.9A)
FMT  A 404 ( 4.2A)
6A7  A 401 (-4.2A)
None
FMT  A 403 (-4.6A)
None
 0.83A 3zosB-5idnA:
20.5		 3zosB-5idnA:
26.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ZOS_B_0LIB1000_1
(EPITHELIAL DISCOIDIN
DOMAIN-CONTAINING
RECEPTOR 1)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		7 / 12 ALA A  50
LYS A  52
ILE A  79
HIS A 149
LEU A 158
ALA A 172
ASP A 173
 6A7  A 401 (-3.3A)
6A7  A 401 ( 2.9A)
6A7  A 401 (-4.2A)
FMT  A 403 (-4.6A)
6A7  A 401 (-4.8A)
6A7  A 401 ( 4.1A)
FMT  A 403 ( 3.3A)
 0.74A 3zosB-5idnA:
20.5		 3zosB-5idnA:
26.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ZOS_B_0LIB1000_1
(EPITHELIAL DISCOIDIN
DOMAIN-CONTAINING
RECEPTOR 1)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		8 / 12 ALA A  50
LYS A  52
ILE A  79
LEU A 142
HIS A 149
ARG A 150
LEU A 158
ALA A 172
 6A7  A 401 (-3.3A)
6A7  A 401 ( 2.9A)
6A7  A 401 (-4.2A)
None
FMT  A 403 (-4.6A)
None
6A7  A 401 (-4.8A)
6A7  A 401 ( 4.1A)
 0.64A 3zosB-5idnA:
20.5		 3zosB-5idnA:
26.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ZTV_A_ADNA1600_1
(NAD NUCLEOTIDASE)		 3rpw ABC TRANSPORTER
(Rhodopseudomonas
palustris) 		5 / 9 GLY A  39
GLY A  40
PHE A 297
GLY A  38
ASP A  36
 FMT  A 370 (-3.8A)
None
GOL  A 364 (-4.9A)
FMT  A 370 (-3.7A)
None
 1.22A 3ztvA-3rpwA:
undetectable		 3ztvA-3rpwA:
21.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4A6N_B_T1CB392_1
(TETX2 PROTEIN)		 2yn2 UNCHARACTERIZED
PROTEIN YNL108C
(Saccharomyces
cerevisiae) 		5 / 11 GLN A  43
HIS A  39
GLY A  40
GLY A 251
GLU A 249
 None
None
None
FMT  A1264 ( 3.7A)
None
 1.13A 4a6nB-2yn2A:
0.0		 4a6nB-2yn2A:
22.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4A7T_A_5FWA1002_1
(SUPEROXIDE DISMUTASE
[CU-ZN])		 2wda PUTATIVE SECRETED
LYASE
(Streptomyces
violaceoruber) 		3 / 3 ASN A 557
TRP A 615
ASP A 456
 FMT  A1769 (-4.5A)
PEG  A1782 (-3.2A)
FMT  A1769 (-3.5A)
 0.99A 4a7tA-2wdaA:
undetectable
4a7tF-2wdaA:
1.2		 4a7tA-2wdaA:
12.35
4a7tF-2wdaA:
12.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4AC9_C_DXCC1475_0
(MJ0495-LIKE PROTEIN)		 1r4p SHIGA-LIKE TOXIN
TYPE II A SUBUNIT
(Escherichia
coli) 		5 / 8 ILE A  54
ASP A  53
VAL A 158
SER A 112
GLY A  80
 None
None
None
FMT  A3015 (-4.0A)
None
 1.36A 4ac9C-1r4pA:
undetectable		 4ac9C-1r4pA:
20.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ACA_B_DXCB1473_0
(TRANSLATION
ELONGATION FACTOR
SELB)		 3pmm PUTATIVE CYTOPLASMIC
PROTEIN
(Klebsiella
pneumoniae) 		5 / 9 ASP A  91
ILE A  90
THR A 115
GLN A  79
ARG A 376
 None
None
None
FMT  A 382 (-3.2A)
None
 1.41A 4acaB-3pmmA:
undetectable
4acaC-3pmmA:
undetectable		 4acaB-3pmmA:
21.40
4acaC-3pmmA:
21.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ACA_C_DXCC1475_0
(TRANSLATION
ELONGATION FACTOR
SELB)		 2dby GTP-BINDING PROTEIN
(Thermus
thermophilus) 		4 / 8 ILE A 103
ILE A  97
VAL A  80
GLY A  78
 FMT  A 401 ( 4.7A)
None
None
None
 0.78A 4acaC-2dbyA:
10.0		 4acaC-2dbyA:
21.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4BKJ_A_STIA1000_1
(EPITHELIAL DISCOIDIN
DOMAIN-CONTAINING
RECEPTOR 1)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		7 / 12 VAL A  35
ALA A  50
ILE A  79
TYR A  99
LEU A 158
ALA A 172
ASP A 173
 6A7  A 401 ( 4.5A)
6A7  A 401 (-3.3A)
6A7  A 401 (-4.2A)
6A7  A 401 (-4.9A)
6A7  A 401 (-4.8A)
6A7  A 401 ( 4.1A)
FMT  A 403 ( 3.3A)
 0.86A 4bkjA-5idnA:
20.6		 4bkjA-5idnA:
26.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4BKJ_B_STIB1000_1
(EPITHELIAL DISCOIDIN
DOMAIN-CONTAINING
RECEPTOR 1)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		6 / 12 VAL A  35
ALA A  50
ILE A  79
LEU A 158
ALA A 172
ASP A 173
 6A7  A 401 ( 4.5A)
6A7  A 401 (-3.3A)
6A7  A 401 (-4.2A)
6A7  A 401 (-4.8A)
6A7  A 401 ( 4.1A)
FMT  A 403 ( 3.3A)
 0.87A 4bkjB-5idnA:
20.6		 4bkjB-5idnA:
26.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4BQF_A_QPSA951_1
(ALPHA-GLUCAN
PHOSPHORYLASE 2,
CYTOSOLIC)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		6 / 6 MET A 311
GLY A 317
TRP A 318
ARG A 355
GLU A 362
ARG A 366
 FMT  A1803 ( 4.3A)
None
None
FMT  A1803 (-2.9A)
None
None
 0.45A 4bqfA-2c4mA:
53.0		 4bqfA-2c4mA:
42.84
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4BQF_B_QPSB951_1
(ALPHA-GLUCAN
PHOSPHORYLASE 2,
CYTOSOLIC)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		6 / 8 MET A 311
TRP A 318
ARG A 355
GLU A 358
GLU A 362
ARG A 366
 FMT  A1803 ( 4.3A)
None
FMT  A1803 (-2.9A)
None
None
None
 0.42A 4bqfB-2c4mA:
53.8		 4bqfB-2c4mA:
42.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4BVA_A_T3A1314_1
(THIOMORPHOLINE-CARBO
XYLATE DEHYDROGENASE)		 4nax GLUTATHIONE
S-TRANSFERASE,
N-TERMINAL DOMAIN
PROTEIN
(Pseudomonas
putida) 		5 / 12 PHE A 139
GLY A 131
VAL A 133
HIS A 137
ARG A 195
 None
GDS  A 301 (-3.4A)
None
FMT  A 303 (-3.7A)
None
 1.45A 4bvaA-4naxA:
undetectable		 4bvaA-4naxA:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4C8B_A_0LIA1000_1
(RECEPTOR-INTERACTING
SERINE/THREONINE-PRO
TEIN KINASE 2)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		7 / 12 ALA A  50
LYS A  52
LEU A  70
HIS A 149
LEU A 158
ALA A 172
ASP A 173
 6A7  A 401 (-3.3A)
6A7  A 401 ( 2.9A)
None
FMT  A 403 (-4.6A)
6A7  A 401 (-4.8A)
6A7  A 401 ( 4.1A)
FMT  A 403 ( 3.3A)
 0.87A 4c8bA-5idnA:
22.5		 4c8bA-5idnA:
25.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CLA_A_CLMA221_0
(TYPE III
CHLORAMPHENICOL
ACETYLTRANSFERASE)		 4elk HY19.3 TCR BETA
CHAIN (MOUSE
VARIABLE DOMAIN,
HUMAN CONSTANT
DOMAIN)
(Mus
musculus) 		5 / 11 GLN B  12
THR B 113
LEU B 118
SER B  88
ILE B  80
 None
FMT  B 304 (-3.2A)
None
FMT  B 304 ( 4.4A)
None
 1.44A 4claA-4elkB:
undetectable		 4claA-4elkB:
21.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CPZ_C_ZMRC1470_2
(NEURAMINIDASE)		 5keu TAURINE DIOXYGENASE
(Paraburkholderia
xenovorans) 		3 / 3 ARG A  48
ARG A  50
TRP A  49
 None
None
FMT  A 407 ( 4.4A)
 1.07A 4cpzC-5keuA:
undetectable		 4cpzC-5keuA:
20.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CX7_B_H4BB600_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 5odo ISOMERASE
(Rhodococcus
erythropolis) 		4 / 8 PHE A 383
HIS A 443
GLU A 445
ILE A 371
 None
FMT  A 603 ( 4.4A)
None
None
 1.21A 4cx7A-5odoA:
undetectable
4cx7B-5odoA:
undetectable		 4cx7A-5odoA:
22.83
4cx7B-5odoA:
22.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DM8_B_REAB1501_1
(RETINOIC ACID
RECEPTOR BETA)		 3nnm CURA
(Lyngbya
majuscula) 		5 / 12 PHE A 103
LEU A 102
ALA A 101
GLY A 117
LEU A  55
 FMT  A 500 (-4.9A)
None
FMT  A 750 ( 4.0A)
None
None
 0.89A 4dm8B-3nnmA:
undetectable		 4dm8B-3nnmA:
23.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DO3_A_0LAA602_1
(FATTY-ACID AMIDE
HYDROLASE 1)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		4 / 5 LEU A 310
LEU A 306
MET A 272
THR A 328
 None
None
FMT  A1795 (-4.9A)
None
 1.13A 4do3A-2c4mA:
undetectable		 4do3A-2c4mA:
21.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DQC_A_017A101_2
(ASPARTYL PROTEASE)		 3lp6 PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE
CATALYTIC SUBUNIT
(Mycobacterium
tuberculosis) 		5 / 9 GLY A  71
ALA A  70
ASP A  19
GLY A 122
ILE A 121
 FMT  A 175 (-4.1A)
FMT  A 175 ( 4.3A)
FMT  A 175 (-3.5A)
None
None
 1.01A 4dqcB-3lp6A:
undetectable		 4dqcB-3lp6A:
21.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DQC_A_017A101_2
(ASPARTYL PROTEASE)		 3opq PHOSPHORIBOSYLAMINOI
MIDAZOLE
CARBOXYLASE,CATALYTI
C SUBUNIT
(Francisella
tularensis) 		5 / 9 GLY A  66
ALA A  65
ASP A  14
GLY A 117
ILE A 116
 PO4  A 164 (-3.7A)
PO4  A 164 (-3.3A)
PO4  A 164 (-2.8A)
FMT  A 166 (-3.3A)
None
 1.05A 4dqcB-3opqA:
undetectable		 4dqcB-3opqA:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4E47_A_SAMA401_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD7)		 6b3p AMY13K
([Eubacterium]
rectale) 		5 / 11 ILE A 197
ALA A 205
GLY A 206
GLU A 207
GLY A 243
 None
None
None
None
FMT  A 417 (-3.0A)
 1.10A 4e47A-6b3pA:
undetectable		 4e47A-6b3pA:
21.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4E47_B_SAMB800_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD7)		 6b3p AMY13K
([Eubacterium]
rectale) 		5 / 11 ILE A 197
ALA A 205
GLY A 206
GLU A 207
GLY A 243
 None
None
None
None
FMT  A 417 (-3.0A)
 1.12A 4e47B-6b3pA:
undetectable		 4e47B-6b3pA:
21.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4E7C_A_ACTA504_0
(UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE)		 2yn2 UNCHARACTERIZED
PROTEIN YNL108C
(Saccharomyces
cerevisiae) 		3 / 3 ARG A  68
TRP A  17
GLY A 251
 None
None
FMT  A1264 ( 3.7A)
 0.58A 4e7cA-2yn2A:
undetectable		 4e7cA-2yn2A:
20.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4EB4_D_D16D402_1
(THYMIDYLATE SYNTHASE)		 3qmj ENOYL-COA HYDRATASE,
ECHA8_6
(Mycobacterium
marinum) 		5 / 10 LEU A 104
GLY A 103
PHE A  58
ASN A 102
LYS A 128
 FMT  A 252 ( 4.6A)
None
None
None
None
 1.43A 4eb4D-3qmjA:
undetectable		 4eb4D-3qmjA:
21.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4EIL_A_FOLA703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5v12 HERCYNYLCYSTEINE
SULFOXIDE LYASE
(Neurospora
crassa) 		5 / 11 ALA C 106
SER C  47
MET C 228
ARG C 438
THR C 107
 EXA  C 247 ( 3.5A)
FMT  C 501 (-3.2A)
None
FMT  C 501 (-3.2A)
EXA  C 247 ( 3.5A)
 1.45A 4eilA-5v12C:
2.9		 4eilA-5v12C:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FFW_B_715B801_1
(DIPEPTIDYL PEPTIDASE
4)		 3ju1 ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN
(Shewanella
oneidensis) 		5 / 12 GLU A 109
GLY A 135
TYR A 163
VAL A 327
TYR A 110
 FMT  A 403 ( 3.9A)
None
None
None
None
 1.28A 4ffwB-3ju1A:
3.4		 4ffwB-3ju1A:
20.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FFW_B_715B801_2
(DIPEPTIDYL PEPTIDASE
4)		 4isa UDP-3-O-[3-HYDROXYMY
RISTOYL]
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Escherichia
coli) 		3 / 3 ARG A 237
TYR A 261
ASN A 268
 None
FMT  A 415 (-3.4A)
None
 0.91A 4ffwB-4isaA:
undetectable		 4ffwB-4isaA:
17.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FH2_A_0RNA303_1
(BETA-LACTAMASE SHV-1)		 1k38 BETA-LACTAMASE OXA-2
(Salmonella
enterica) 		5 / 10 SER A 115
LYS A 205
THR A 206
GLY A 207
ARG A 244
 FMT  A 401 (-2.4A)
FMT  A 401 ( 3.8A)
FMT  A 401 (-3.7A)
FMT  A 401 (-3.6A)
FMT  A 401 (-2.6A)
 0.71A 4fh2A-1k38A:
17.9		 4fh2A-1k38A:
25.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FO4_B_MOAB502_1
(INOSINE
5'-MONOPHOSPHATE
DEHYDROGENASE)		 6ccz SERINE
HYDROXYMETHYLTRANSFE
RASE
(Medicago
truncatula) 		4 / 8 SER A 319
ASN A 116
GLY A 322
CYH A 367
 FMT  A 613 (-4.5A)
LLP  A 318 ( 3.9A)
None
None
 0.83A 4fo4B-6cczA:
undetectable		 4fo4B-6cczA:
14.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FP9_C_SAMC401_1
(METHYLTRANSFERASE
NSUN4)		 2ymv ACG NITROREDUCTASE
(Mycolicibacteriu
m
smegmatis) 		3 / 3 ASP A 251
ARG A  86
ASP A 242
 None
FMT  A1333 (-2.9A)
None
 0.82A 4fp9C-2ymvA:
undetectable		 4fp9C-2ymvA:
22.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FP9_F_SAMF401_1
(METHYLTRANSFERASE
NSUN4)		 2ymv ACG NITROREDUCTASE
(Mycolicibacteriu
m
smegmatis) 		3 / 3 ASP A 251
ARG A  86
ASP A 242
 None
FMT  A1333 (-2.9A)
None
 0.83A 4fp9F-2ymvA:
undetectable		 4fp9F-2ymvA:
22.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FUB_A_ACTA311_0
(UROKINASE-TYPE
PLASMINOGEN
ACTIVATOR)		 4e4f MANNONATE
DEHYDRATASE
(Pectobacterium
carotovorum) 		3 / 3 TYR A 188
ARG A 216
HIS A 214
 None
None
FMT  A 506 ( 4.7A)
 1.23A 4fubA-4e4fA:
undetectable		 4fubA-4e4fA:
19.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4G10_A_ACTA301_0
(GLUTATHIONE
S-TRANSFERASE
HOMOLOG)		 6beg SCAFFOLD PROTEIN D13
(Vaccinia
virus) 		4 / 6 PRO A  88
ILE A 428
TYR A 273
TYR A 283
 FMT  A 601 ( 4.9A)
FMT  A 601 ( 4.7A)
None
None
 1.07A 4g10A-6begA:
undetectable		 4g10A-6begA:
undetectable
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4G19_A_ACTA304_0
(GLUTATHIONE
TRANSFERASE GTE1)		 4lmw GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		4 / 5 ILE A   6
LEU A  37
LYS A  38
ASN A  80
 FMT  A 308 ( 4.7A)
FMT  A 308 ( 4.4A)
FMT  A 308 ( 4.1A)
FMT  A 308 ( 4.8A)
 0.51A 4g19A-4lmwA:
38.6		 4g19A-4lmwA:
59.06
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4G19_D_ACTD302_0
(GLUTATHIONE
TRANSFERASE GTE1)		 4lmw GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		3 / 3 TYR A  46
PHE A 130
ARG A 153
 FMT  A 301 ( 4.9A)
None
FMT  A 305 ( 4.0A)
 0.89A 4g19D-4lmwA:
38.5		 4g19D-4lmwA:
59.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4G1B_A_ECNA403_1
(FLAVOHEMOGLOBIN)		 5ab8 GROUP 1 TRUNCATED
HEMOGLOBIN GLBN
(Mycobacterium
tuberculosis) 		5 / 12 PHE A  32
TYR A  33
PHE A  46
VAL A  94
LEU A  98
 FMT  A1129 ( 4.9A)
FMT  A1129 (-4.1A)
HEM  A 144 ( 3.9A)
HEM  A 144 (-4.2A)
None
 0.85A 4g1bA-5ab8A:
9.3		 4g1bA-5ab8A:
15.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4GC9_A_SAMA401_1
(DIMETHYLADENOSINE
TRANSFERASE 1,
MITOCHONDRIAL)		 3gjy SPERMIDINE SYNTHASE
(Corynebacterium
glutamicum) 		3 / 3 GLU A 117
ASP A 119
ASP A 144
 FMT  A 315 (-3.6A)
None
None
 0.63A 4gc9A-3gjyA:
8.7		 4gc9A-3gjyA:
22.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4H2F_A_ADNA601_1
(5'-NUCLEOTIDASE)		 3c9f 5'-NUCLEOTIDASE
(Candida
albicans) 		5 / 9 ASN A 386
GLY A 388
ARG A 391
PHE A 410
PHE A 521
 None
None
FMT  A 607 (-2.7A)
None
None
 0.86A 4h2fA-3c9fA:
14.0		 4h2fA-3c9fA:
22.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4HTF_A_SAMA301_0
(S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE)		 3gjy SPERMIDINE SYNTHASE
(Corynebacterium
glutamicum) 		5 / 12 GLY A  94
GLY A  95
GLY A  96
LEU A 118
ALA A 145
 None
FMT  A 315 (-4.3A)
FMT  A 315 ( 4.2A)
None
None
 0.78A 4htfA-3gjyA:
12.8		 4htfA-3gjyA:
21.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4HTF_B_SAMB301_0
(S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE)		 3gjy SPERMIDINE SYNTHASE
(Corynebacterium
glutamicum) 		5 / 12 GLY A  94
GLY A  95
GLY A  96
LEU A 118
ALA A 145
 None
FMT  A 315 (-4.3A)
FMT  A 315 ( 4.2A)
None
None
 0.80A 4htfB-3gjyA:
12.9		 4htfB-3gjyA:
21.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4HVR_A_SALA203_1
(3-HYDROXYANTHRANILAT
E 3,4-DIOXYGENASE)		 4e4f MANNONATE
DEHYDRATASE
(Pectobacterium
carotovorum) 		4 / 7 HIS A 214
ASP A 212
VAL A 265
GLU A 264
 FMT  A 506 ( 4.7A)
MG  A 504 ( 2.4A)
None
MG  A 504 ( 2.5A)
 1.03A 4hvrA-4e4fA:
undetectable		 4hvrA-4e4fA:
17.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4I13_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 2is8 MOLYBDOPTERIN
BIOSYNTHESIS ENZYME,
MOAB
(Thermus
thermophilus) 		3 / 3 ASP A  20
ARG A 136
THR A   8
 FMT  A1003 (-3.7A)
None
FMT  A1003 (-4.1A)
 0.71A 4i13A-2is8A:
undetectable		 4i13A-2is8A:
21.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4I41_A_MIXA500_1
(SERINE/THREONINE-PRO
TEIN KINASE PIM-1)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		8 / 12 VAL A  35
ALA A  50
ILE A  79
ASP A 103
ASP A 151
ASN A 156
LEU A 158
ASP A 173
 6A7  A 401 ( 4.5A)
6A7  A 401 (-3.3A)
6A7  A 401 (-4.2A)
6A7  A 401 ( 4.9A)
FMT  A 403 (-3.9A)
FMT  A 403 ( 4.7A)
6A7  A 401 (-4.8A)
FMT  A 403 ( 3.3A)
 1.00A 4i41A-5idnA:
24.7		 4i41A-5idnA:
24.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4I41_A_MIXA500_1
(SERINE/THREONINE-PRO
TEIN KINASE PIM-1)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		8 / 12 VAL A  35
ALA A  50
ILE A  79
ASP A 103
ASP A 151
LYS A 153
ASN A 156
LEU A 158
 6A7  A 401 ( 4.5A)
6A7  A 401 (-3.3A)
6A7  A 401 (-4.2A)
6A7  A 401 ( 4.9A)
FMT  A 403 (-3.9A)
FMT  A 403 ( 4.1A)
FMT  A 403 ( 4.7A)
6A7  A 401 (-4.8A)
 1.12A 4i41A-5idnA:
24.7		 4i41A-5idnA:
24.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4IAA_A_RTZA401_1
(SERINE/THREONINE-PRO
TEIN KINASE PIM-1)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		6 / 11 VAL A  35
ALA A  50
LYS A  52
ASP A 103
LEU A 158
ASP A 173
 6A7  A 401 ( 4.5A)
6A7  A 401 (-3.3A)
6A7  A 401 ( 2.9A)
6A7  A 401 ( 4.9A)
6A7  A 401 (-4.8A)
FMT  A 403 ( 3.3A)
 0.99A 4iaaA-5idnA:
24.4		 4iaaA-5idnA:
24.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4IV0_A_SAMA302_0
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE,
PUTATIVE)		 5eso 2-SUCCINYL-5-ENOLPYR
UVYL-6-HYDROXY-3-CYC
LOHEXENE-1-CARBOXYLA
TE SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 284
GLY A 276
GLY A 233
ARG A 303
LEU A 288
 None
FMT  A 603 ( 3.8A)
FMT  A 603 ( 4.7A)
None
None
 1.04A 4iv0A-5esoA:
undetectable		 4iv0A-5esoA:
19.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4JDS_A_SAMA401_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD7)		 6b3p AMY13K
([Eubacterium]
rectale) 		5 / 11 ILE A 197
ALA A 205
GLY A 206
GLU A 207
GLY A 243
 None
None
None
None
FMT  A 417 (-3.0A)
 1.13A 4jdsA-6b3pA:
undetectable		 4jdsA-6b3pA:
21.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4JDS_B_SAMB401_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD7)		 6b3p AMY13K
([Eubacterium]
rectale) 		5 / 11 ILE A 197
ALA A 205
GLY A 206
GLU A 207
GLY A 243
 None
None
None
None
FMT  A 417 (-3.0A)
 1.11A 4jdsB-6b3pA:
undetectable		 4jdsB-6b3pA:
21.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KTT_A_SAMA405_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 2qfq 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Escherichia
coli) 		4 / 8 HIS A 385
LYS A 411
SER A  25
ASP A 313
 FMT  A 601 (-4.3A)
FMT  A 602 (-2.8A)
None
S3P  A 701 ( 2.8A)
 1.09A 4kttA-2qfqA:
undetectable		 4kttA-2qfqA:
23.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KTT_C_SAMC404_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 2qfq 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Escherichia
coli) 		4 / 8 HIS A 385
LYS A 411
SER A  25
ASP A 313
 FMT  A 601 (-4.3A)
FMT  A 602 (-2.8A)
None
S3P  A 701 ( 2.8A)
 1.06A 4kttC-2qfqA:
undetectable		 4kttC-2qfqA:
23.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KYA_A_FOLA703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5v12 HERCYNYLCYSTEINE
SULFOXIDE LYASE
(Neurospora
crassa) 		5 / 11 ALA C 106
SER C  47
MET C 228
ARG C 438
THR C 107
 EXA  C 247 ( 3.5A)
FMT  C 501 (-3.2A)
None
FMT  C 501 (-3.2A)
EXA  C 247 ( 3.5A)
 1.45A 4kyaA-5v12C:
2.9		 4kyaA-5v12C:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KYA_D_FOLD703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5v12 HERCYNYLCYSTEINE
SULFOXIDE LYASE
(Neurospora
crassa) 		5 / 12 ALA C 106
SER C  47
MET C 228
ARG C 438
THR C 107
 EXA  C 247 ( 3.5A)
FMT  C 501 (-3.2A)
None
FMT  C 501 (-3.2A)
EXA  C 247 ( 3.5A)
 1.47A 4kyaD-5v12C:
undetectable		 4kyaD-5v12C:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KYA_E_FOLE703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5v12 HERCYNYLCYSTEINE
SULFOXIDE LYASE
(Neurospora
crassa) 		5 / 11 ALA C 106
SER C  47
MET C 228
ARG C 438
THR C 107
 EXA  C 247 ( 3.5A)
FMT  C 501 (-3.2A)
None
FMT  C 501 (-3.2A)
EXA  C 247 ( 3.5A)
 1.44A 4kyaE-5v12C:
undetectable		 4kyaE-5v12C:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KYA_F_FOLF703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5v12 HERCYNYLCYSTEINE
SULFOXIDE LYASE
(Neurospora
crassa) 		5 / 12 ALA C 106
SER C  47
MET C 228
ARG C 438
THR C 107
 EXA  C 247 ( 3.5A)
FMT  C 501 (-3.2A)
None
FMT  C 501 (-3.2A)
EXA  C 247 ( 3.5A)
 1.45A 4kyaF-5v12C:
undetectable		 4kyaF-5v12C:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KYA_G_FOLG703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5v12 HERCYNYLCYSTEINE
SULFOXIDE LYASE
(Neurospora
crassa) 		5 / 11 ALA C 106
SER C  47
MET C 228
ARG C 438
THR C 107
 EXA  C 247 ( 3.5A)
FMT  C 501 (-3.2A)
None
FMT  C 501 (-3.2A)
EXA  C 247 ( 3.5A)
 1.42A 4kyaG-5v12C:
2.4		 4kyaG-5v12C:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KYA_H_FOLH703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5v12 HERCYNYLCYSTEINE
SULFOXIDE LYASE
(Neurospora
crassa) 		5 / 12 ALA C 106
SER C  47
MET C 228
ARG C 438
THR C 107
 EXA  C 247 ( 3.5A)
FMT  C 501 (-3.2A)
None
FMT  C 501 (-3.2A)
EXA  C 247 ( 3.5A)
 1.48A 4kyaH-5v12C:
undetectable		 4kyaH-5v12C:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4L1A_A_AB1A101_2
(MDR769 HIV-1
PROTEASE)		 6cjb CYSTATHIONINE
BETA-LYASE
(Legionella
pneumophila) 		4 / 6 ASP A  98
GLY A 356
PRO A 339
THR A 343
 None
None
None
FMT  A 401 (-3.6A)
 1.05A 4l1aB-6cjbA:
undetectable		 4l1aB-6cjbA:
19.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4L1W_A_STRA402_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C2)		 5dnw SHKAI2IB
(Striga
hermonthica) 		4 / 7 VAL A 224
ILE A 228
LEU A  70
LEU A 198
 FMT  A 303 ( 4.4A)
None
None
None
 1.00A 4l1wA-5dnwA:
undetectable		 4l1wA-5dnwA:
24.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4L6V_1_PQN12001_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1
FUSION PROTEIN OF
PHOTOSYSTEM I
SUBUNIT III AND
SUBUNIT IX)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		5 / 11 GLY A 114
ARG A 117
ALA A 120
GLY A 111
ALA A 271
 PO4  A1794 (-3.4A)
None
None
None
FMT  A1795 ( 3.8A)
 1.18A 4l6v1-2c4mA:
undetectable
4l6v6-2c4mA:
undetectable		 4l6v1-2c4mA:
21.00
4l6v6-2c4mA:
9.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LXZ_C_SHHC406_1
(HISTONE DEACETYLASE
2)		 5kob PEPTIDE DEFORMYLASE
(Paraburkholderia
xenovorans) 		5 / 12 PRO A 152
GLY A 162
PHE A 161
GLY A  98
TYR A 151
 None
None
None
FMT  A 202 ( 4.3A)
None
 1.20A 4lxzC-5kobA:
undetectable		 4lxzC-5kobA:
18.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4M11_C_MXMC606_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3pmm PUTATIVE CYTOPLASMIC
PROTEIN
(Klebsiella
pneumoniae) 		5 / 12 MET A  86
ILE A  28
VAL A  31
ALA A 365
LEU A 371
 FMT  A 387 ( 4.1A)
None
None
None
None
 1.18A 4m11C-3pmmA:
undetectable		 4m11C-3pmmA:
20.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4M2R_A_BZ1A302_2
(CARBONIC ANHYDRASE 2)		 4c6o CAD PROTEIN
(Homo
sapiens) 		4 / 4 HIS A1770
GLU A1694
HIS A1690
LEU A1474
 None
None
FMT  A2824 (-4.2A)
None
 1.25A 4m2rA-4c6oA:
undetectable		 4m2rA-4c6oA:
22.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4M5M_A_DX4A401_0
(2-AMINO-4-HYDROXY-6-
HYDROXYMETHYLDIHYDRO
PTERIDINE
PYROPHOSPHOKINASE)		 1xmx HYPOTHETICAL PROTEIN
VC1899
(Vibrio
cholerae) 		4 / 8 GLY A 249
THR A 254
LEU A 171
PHE A 246
 None
FMT  A 406 (-4.3A)
None
None
 1.19A 4m5mA-1xmxA:
undetectable		 4m5mA-1xmxA:
22.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4M6K_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5u4h UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE
(Acinetobacter
baumannii) 		5 / 12 ILE A 390
LEU A 407
PHE A 375
ARG A 372
ILE A 245
 None
None
None
FMT  A 507 (-3.7A)
None
 1.02A 4m6kA-5u4hA:
undetectable		 4m6kA-5u4hA:
18.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MK4_A_CHDA504_0
(FERROCHELATASE,
MITOCHONDRIAL)		 3m49 TRANSKETOLASE
(Bacillus
anthracis) 		4 / 8 MET A 589
VAL A 603
VAL A 626
GLY A 627
 None
FMT  A 715 (-4.9A)
None
None
 0.99A 4mk4A-3m49A:
undetectable		 4mk4A-3m49A:
19.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MMD_B_29EB603_1
(TRANSPORTER)		 3cp7 ALKALINE SERINE
PROTEASE AL20
(Nesterenkonia
aethiopica) 		5 / 12 VAL A  12
GLY A  40
SER A 169
SER A 168
GLY A 171
 None
None
FMT  A 219 (-2.6A)
None
None
 1.14A 4mmdB-3cp7A:
undetectable		 4mmdB-3cp7A:
15.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4N09_C_ADNC401_2
(ADENOSINE KINASE)		 6cjb CYSTATHIONINE
BETA-LYASE
(Legionella
pneumophila) 		4 / 5 ASN A 202
SER A 196
LEU A 329
ASN A 149
 None
LLP  A 199 ( 2.7A)
LLP  A 199 (-4.3A)
FMT  A 401 (-3.2A)
 1.12A 4n09C-6cjbA:
undetectable		 4n09C-6cjbA:
14.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4N48_B_SAMB601_1
(CAP-SPECIFIC MRNA
(NUCLEOSIDE-2'-O-)-M
ETHYLTRANSFERASE 1)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		4 / 5 PRO A 194
GLY A 204
ASP A 107
ASP A 124
 None
FMT  A1798 (-3.7A)
None
None
 1.08A 4n48B-2c4mA:
undetectable		 4n48B-2c4mA:
19.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4N9K_A_CEDA301_1
(BETA-LACTAMASE)		 1k38 BETA-LACTAMASE OXA-2
(Salmonella
enterica) 		7 / 12 ALA A  66
SER A  67
SER A 115
LYS A 205
THR A 206
GLY A 207
ARG A 244
 None
KCX  A  70 ( 2.7A)
FMT  A 401 (-2.4A)
FMT  A 401 ( 3.8A)
FMT  A 401 (-3.7A)
FMT  A 401 (-3.6A)
FMT  A 401 (-2.6A)
 0.65A 4n9kA-1k38A:
19.3		 4n9kA-1k38A:
24.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4N9K_A_CEDA301_1
(BETA-LACTAMASE)		 5kzh BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 12 ALA A  79
SER A  80
SER A 127
LYS A 217
GLY A 219
ARG A 260
 FMT  A 301 (-3.2A)
FMT  A 301 (-2.5A)
FMT  A 301 (-3.3A)
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
 0.63A 4n9kA-5kzhA:
19.8		 4n9kA-5kzhA:
23.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4N9K_B_CEDB301_1
(BETA-LACTAMASE)		 1k38 BETA-LACTAMASE OXA-2
(Salmonella
enterica) 		7 / 12 ALA A  66
SER A  67
SER A 115
LYS A 205
THR A 206
GLY A 207
ARG A 244
 None
KCX  A  70 ( 2.7A)
FMT  A 401 (-2.4A)
FMT  A 401 ( 3.8A)
FMT  A 401 (-3.7A)
FMT  A 401 (-3.6A)
FMT  A 401 (-2.6A)
 0.62A 4n9kB-1k38A:
19.3		 4n9kB-1k38A:
24.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4N9K_B_CEDB301_1
(BETA-LACTAMASE)		 5kzh BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 12 ALA A  79
SER A  80
SER A 127
LYS A 217
GLY A 219
ARG A 260
 FMT  A 301 (-3.2A)
FMT  A 301 (-2.5A)
FMT  A 301 (-3.3A)
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
 0.61A 4n9kB-5kzhA:
19.7		 4n9kB-5kzhA:
23.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4NDN_A_SAMA407_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 2qfq 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Escherichia
coli) 		4 / 8 HIS A 385
LYS A 411
SER A  25
ASP A 313
 FMT  A 601 (-4.3A)
FMT  A 602 (-2.8A)
None
S3P  A 701 ( 2.8A)
 1.05A 4ndnA-2qfqA:
undetectable		 4ndnA-2qfqA:
23.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4NDN_C_SAMC405_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 2qfq 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Escherichia
coli) 		4 / 7 HIS A 385
LYS A 411
SER A  25
ASP A 313
 FMT  A 601 (-4.3A)
FMT  A 602 (-2.8A)
None
S3P  A 701 ( 2.8A)
 1.04A 4ndnC-2qfqA:
undetectable		 4ndnC-2qfqA:
23.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4NKX_B_STRB601_1
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 1k77 HYPOTHETICAL PROTEIN
YGBM
(Escherichia
coli) 		6 / 12 LEU A 145
PHE A 155
GLY A 107
ALA A  75
ILE A 164
VAL A 104
 FMT  A 304 ( 4.7A)
None
None
None
None
None
 1.36A 4nkxB-1k77A:
0.0		 4nkxB-1k77A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4NKX_B_STRB601_1
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 3cj8 2,3,4,5-TETRAHYDROPY
RIDINE-2,6-DICARBOXY
LATE
N-ACETYLTRANSFERASE
(Enterococcus
faecalis) 		6 / 12 ALA A 175
GLY A 207
ALA A 210
ALA A 187
ILE A 171
VAL A 204
 None
FMT  A 311 ( 4.4A)
None
None
None
None
 1.33A 4nkxB-3cj8A:
undetectable		 4nkxB-3cj8A:
21.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4NX6_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 2is8 MOLYBDOPTERIN
BIOSYNTHESIS ENZYME,
MOAB
(Thermus
thermophilus) 		4 / 4 ILE A  26
ASP A  20
ARG A 136
THR A   8
 None
FMT  A1003 (-3.7A)
None
FMT  A1003 (-4.1A)
 1.20A 4nx6A-2is8A:
undetectable		 4nx6A-2is8A:
21.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4NX7_A_FOLA202_1
(DIHYDROFOLATE
REDUCTASE)		 2is8 MOLYBDOPTERIN
BIOSYNTHESIS ENZYME,
MOAB
(Thermus
thermophilus) 		4 / 4 ILE A  26
ASP A  20
ARG A 136
THR A   8
 None
FMT  A1003 (-3.7A)
None
FMT  A1003 (-4.1A)
 1.20A 4nx7A-2is8A:
undetectable		 4nx7A-2is8A:
21.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4O33_A_TZNA501_1
(PHOSPHOGLYCERATE
KINASE 1)		 3q3v PHOSPHOGLYCERATE
KINASE
(Campylobacter
jejuni) 		9 / 12 GLY A 199
GLY A 223
GLY A 224
PHE A 227
LEU A 241
MET A 295
LEU A 297
GLY A 324
VAL A 325
 None
FMT  A 403 (-3.9A)
FMT  A 403 ( 4.8A)
FMT  A 403 (-4.4A)
None
None
None
FMT  A 403 ( 3.8A)
None
 0.49A 4o33A-3q3vA:
52.8		 4o33A-3q3vA:
46.06
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4O3F_A_TZNA501_1
(PHOSPHOGLYCERATE
KINASE 1)		 3q3v PHOSPHOGLYCERATE
KINASE
(Campylobacter
jejuni) 		8 / 12 GLY A 199
GLY A 223
GLY A 224
PHE A 227
LEU A 241
MET A 295
LEU A 297
GLY A 324
 None
FMT  A 403 (-3.9A)
FMT  A 403 ( 4.8A)
FMT  A 403 (-4.4A)
None
None
None
FMT  A 403 ( 3.8A)
 0.47A 4o3fA-3q3vA:
51.0		 4o3fA-3q3vA:
45.14
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4O3F_A_TZNA501_1
(PHOSPHOGLYCERATE
KINASE 1)		 3q3v PHOSPHOGLYCERATE
KINASE
(Campylobacter
jejuni) 		8 / 12 GLY A 199
GLY A 223
GLY A 224
PHE A 227
MET A 295
LEU A 297
GLY A 324
VAL A 325
 None
FMT  A 403 (-3.9A)
FMT  A 403 ( 4.8A)
FMT  A 403 (-4.4A)
None
None
FMT  A 403 ( 3.8A)
None
 0.42A 4o3fA-3q3vA:
51.0		 4o3fA-3q3vA:
45.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4O7G_A_ASCA303_0
(PROBABLE
TRANSMEMBRANE
ASCORBATE
FERRIREDUCTASE 2)		 6brm PUTATIVE
METAL-DEPENDENT
ISOTHIOCYANATE
HYDROLASE SAXA
(Pectobacterium
carotovorum) 		4 / 7 HIS A 128
ILE A 198
PHE A  35
ASN A 226
 ZN  A 301 (-3.3A)
None
FMT  A 303 (-4.1A)
None
 1.31A 4o7gA-6brmA:
undetectable
4o7gB-6brmA:
undetectable		 4o7gA-6brmA:
undetectable
4o7gB-6brmA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4O7G_B_ASCB304_0
(PROBABLE
TRANSMEMBRANE
ASCORBATE
FERRIREDUCTASE 2)		 6brm PUTATIVE
METAL-DEPENDENT
ISOTHIOCYANATE
HYDROLASE SAXA
(Pectobacterium
carotovorum) 		4 / 6 HIS A 128
ILE A 198
PHE A  35
ASN A 226
 ZN  A 301 (-3.3A)
None
FMT  A 303 (-4.1A)
None
 1.34A 4o7gB-6brmA:
undetectable		 4o7gB-6brmA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4O8F_A_BRLA501_2
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 1xmx HYPOTHETICAL PROTEIN
VC1899
(Vibrio
cholerae) 		4 / 5 GLY A 249
LEU A 275
LEU A 168
LEU A 366
 None
None
FMT  A 406 (-4.2A)
None
 0.80A 4o8fA-1xmxA:
undetectable		 4o8fA-1xmxA:
23.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4OBW_D_SAMD601_0
(2-METHOXY-6-POLYPREN
YL-1,4-BENZOQUINOL
METHYLASE,
MITOCHONDRIAL)		 3gjy SPERMIDINE SYNTHASE
(Corynebacterium
glutamicum) 		5 / 12 ALA A 166
GLY A 167
ILE A  47
ASN A  48
GLY A  96
 None
None
None
None
FMT  A 315 ( 4.2A)
 1.32A 4obwD-3gjyA:
13.4		 4obwD-3gjyA:
23.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ODJ_A_SAMA500_0
(S-ADENOSYLMETHIONINE
SYNTHASE)		 2qfq 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Escherichia
coli) 		4 / 7 HIS A 385
LYS A 411
SER A  25
ASP A 313
 FMT  A 601 (-4.3A)
FMT  A 602 (-2.8A)
None
S3P  A 701 ( 2.8A)
 1.13A 4odjA-2qfqA:
undetectable		 4odjA-2qfqA:
22.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ODJ_A_SAMA500_0
(S-ADENOSYLMETHIONINE
SYNTHASE)		 6brm PUTATIVE
METAL-DEPENDENT
ISOTHIOCYANATE
HYDROLASE SAXA
(Pectobacterium
carotovorum) 		4 / 7 HIS A  72
ASP A  71
SER A  38
PHE A  35
 ZN  A 302 (-3.3A)
ZN  A 302 (-2.7A)
None
FMT  A 303 (-4.1A)
 1.27A 4odjA-6brmA:
undetectable		 4odjA-6brmA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4OLT_A_GCSA303_1
(CHITOSANASE)		 3nnm CURA
(Lyngbya
majuscula) 		4 / 6 ILE A  61
ASP A  60
GLY A  56
VAL A 186
 None
FMT  A 755 (-4.2A)
None
None
 1.00A 4oltA-3nnmA:
undetectable		 4oltA-3nnmA:
20.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4OLT_B_GCSB303_1
(CHITOSANASE)		 3nnm CURA
(Lyngbya
majuscula) 		4 / 6 ILE A  61
ASP A  60
GLY A  56
VAL A 186
 None
FMT  A 755 (-4.2A)
None
None
 1.01A 4oltB-3nnmA:
undetectable		 4oltB-3nnmA:
20.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4OTI_A_MI1A1001_1
(SERINE/THREONINE-PRO
TEIN KINASE N1)		 6cmj CALCIUM/CALMODULIN-D
EPENDENT PROTEIN
KINASE KINASE 2
(Homo
sapiens) 		7 / 12 GLY A 172
GLY A 177
VAL A 179
ALA A 192
VAL A 249
LEU A 319
ALA A 329
 F6J  A 501 ( 3.9A)
FMT  A 503 (-3.6A)
F6J  A 501 (-4.6A)
F6J  A 501 (-3.4A)
None
F6J  A 501 (-4.5A)
F6J  A 501 ( 4.0A)
 0.51A 4otiA-6cmjA:
24.3		 4otiA-6cmjA:
14.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4P3R_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 2is8 MOLYBDOPTERIN
BIOSYNTHESIS ENZYME,
MOAB
(Thermus
thermophilus) 		3 / 3 ASP A  20
ARG A 136
THR A   8
 FMT  A1003 (-3.7A)
None
FMT  A1003 (-4.1A)
 0.72A 4p3rA-2is8A:
undetectable		 4p3rA-2is8A:
21.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4P6X_E_HCYE900_1
(GLUCOCORTICOID
RECEPTOR)		 5l10 N-ACYLHOMOSERINE
LACTONE DEPENDENT
REGULATORY PROTEIN
(Burkholderia
cenocepacia) 		5 / 12 LEU A 129
GLY A 119
MET A 162
LEU A 161
ILE A  78
 None
FMT  A 202 (-3.4A)
None
None
GOL  A 201 ( 4.1A)
 1.36A 4p6xE-5l10A:
undetectable		 4p6xE-5l10A:
18.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4P7N_A_GCSA702_1
(POLY-BETA-1,6-N-ACET
YL-D-GLUCOSAMINE
N-DEACETYLASE)		 4lmw GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		3 / 3 ASP A 250
TYR A  39
TRP A  43
 None
FMT  A 306 (-4.5A)
None
 1.16A 4p7nA-4lmwA:
undetectable		 4p7nA-4lmwA:
23.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4PCU_A_SAMA603_0
(CYSTATHIONINE
BETA-SYNTHASE)		 3mez MANNOSE-SPECIFIC
LECTIN 3 CHAIN 1
MANNOSE-SPECIFIC
LECTIN 3 CHAIN 2
(Crocus
vernus;
Crocus
vernus) 		4 / 7 ASP B  25
THR B  23
ILE B  97
ASP A   1
 None
None
FMT  B 115 ( 4.2A)
None
 1.02A 4pcuA-3mezB:
undetectable		 4pcuA-3mezB:
12.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4PGH_B_SAMB401_0
(CAFFEIC ACID
O-METHYLTRANSFERASE)		 6c5b METHYLTRANSFERASE
(Lysobacter
antibioticus) 		6 / 12 ASP A 180
GLY A 182
ASP A 205
ASP A 232
ASP A 252
TRP A 253
 FMT  A 502 (-2.6A)
SAH  A 501 (-4.0A)
SAH  A 501 (-2.9A)
SAH  A 501 (-3.5A)
SAH  A 501 (-4.0A)
None
 0.54A 4pghB-6c5bA:
17.5		 4pghB-6c5bA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4PST_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 2is8 MOLYBDOPTERIN
BIOSYNTHESIS ENZYME,
MOAB
(Thermus
thermophilus) 		3 / 3 ILE A  26
ASP A  20
ARG A 136
 None
FMT  A1003 (-3.7A)
None
 0.84A 4pstA-2is8A:
undetectable		 4pstA-2is8A:
21.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Q15_A_HFGA803_1
(PROLINE--TRNA LIGASE)		 6b3p AMY13K
([Eubacterium]
rectale) 		3 / 3 GLU A 366
THR A 224
HIS A 226
 None
FMT  A 422 ( 2.8A)
FMT  A 420 (-3.5A)
 0.82A 4q15A-6b3pA:
undetectable		 4q15A-6b3pA:
17.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Q1W_A_017A104_1
(ASPARTYL PROTEASE)		 3lp6 PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE
CATALYTIC SUBUNIT
(Mycobacterium
tuberculosis) 		5 / 9 GLY A  71
ALA A  70
ASP A  19
GLY A 122
ILE A 121
 FMT  A 175 (-4.1A)
FMT  A 175 ( 4.3A)
FMT  A 175 (-3.5A)
None
None
 1.00A 4q1wA-3lp6A:
undetectable		 4q1wA-3lp6A:
17.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QB9_E_PARE500_1
(ENHANCED
INTRACELLULAR
SURVIVAL PROTEIN)		 2poe CYCLOPHILIN-LIKE
PROTEIN, PUTATIVE
(Cryptosporidium
parvum) 		5 / 12 THR A 116
ASP A  88
ASP A  89
TYR A 135
GLY A 109
 None
FMT  A 202 (-4.8A)
None
FMT  A 203 ( 4.1A)
None
 1.50A 4qb9E-2poeA:
undetectable		 4qb9E-2poeA:
17.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QB9_F_PARF500_1
(ENHANCED
INTRACELLULAR
SURVIVAL PROTEIN)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 11 THR A 128
GLU A 173
ASP A 203
ASP A 204
GLY A 151
 FMT  A 501 (-3.6A)
None
None
None
None
 1.32A 4qb9F-4kv7A:
undetectable		 4qb9F-4kv7A:
23.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QRC_A_0LIA802_1
(FIBROBLAST GROWTH
FACTOR RECEPTOR 4)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		5 / 12 ALA A  50
GLU A  66
LEU A 142
ARG A 150
ALA A 172
 6A7  A 401 (-3.3A)
FMT  A 404 ( 4.2A)
None
None
6A7  A 401 ( 4.1A)
 0.95A 4qrcA-5idnA:
15.9		 4qrcA-5idnA:
23.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QRC_A_0LIA802_1
(FIBROBLAST GROWTH
FACTOR RECEPTOR 4)		 6fek PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE RECEPTOR RET
(Homo
sapiens) 		5 / 12 ALA A 756
GLU A 775
VAL A 804
LEU A 865
ARG A 873
 ADN  A1104 (-3.4A)
None
ADN  A1104 ( 4.6A)
None
FMT  A1101 (-2.8A)
 1.05A 4qrcA-6fekA:
34.4		 4qrcA-6fekA:
25.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QVL_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 6ccz SERINE
HYDROXYMETHYLTRANSFE
RASE
(Medicago
truncatula) 		5 / 11 HIS A 209
SER A 211
THR A 313
THR A 314
THR A 315
 LLP  A 318 (-3.5A)
LLP  A 318 ( 3.8A)
None
FMT  A 613 ( 4.6A)
FMT  A 613 (-3.6A)
 1.43A 4qvlV-6cczA:
undetectable
4qvlb-6cczA:
undetectable		 4qvlV-6cczA:
16.59
4qvlb-6cczA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QVL_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 6ccz SERINE
HYDROXYMETHYLTRANSFE
RASE
(Medicago
truncatula) 		5 / 11 HIS A 209
SER A 211
THR A 313
THR A 314
THR A 315
 LLP  A 318 (-3.5A)
LLP  A 318 ( 3.8A)
None
FMT  A 613 ( 4.6A)
FMT  A 613 (-3.6A)
 1.43A 4qvlH-6cczA:
undetectable
4qvlN-6cczA:
undetectable		 4qvlH-6cczA:
16.59
4qvlN-6cczA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QVW_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 6ccz SERINE
HYDROXYMETHYLTRANSFE
RASE
(Medicago
truncatula) 		5 / 11 HIS A 209
SER A 211
THR A 313
THR A 314
THR A 315
 LLP  A 318 (-3.5A)
LLP  A 318 ( 3.8A)
None
FMT  A 613 ( 4.6A)
FMT  A 613 (-3.6A)
 1.41A 4qvwV-6cczA:
undetectable
4qvwb-6cczA:
undetectable		 4qvwV-6cczA:
16.59
4qvwb-6cczA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QVW_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 6ccz SERINE
HYDROXYMETHYLTRANSFE
RASE
(Medicago
truncatula) 		5 / 11 HIS A 209
SER A 211
THR A 313
THR A 314
THR A 315
 LLP  A 318 (-3.5A)
LLP  A 318 ( 3.8A)
None
FMT  A 613 ( 4.6A)
FMT  A 613 (-3.6A)
 1.41A 4qvwH-6cczA:
undetectable
4qvwN-6cczA:
undetectable		 4qvwH-6cczA:
16.59
4qvwN-6cczA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QVY_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 6ccz SERINE
HYDROXYMETHYLTRANSFE
RASE
(Medicago
truncatula) 		5 / 11 HIS A 209
SER A 211
THR A 313
THR A 314
THR A 315
 LLP  A 318 (-3.5A)
LLP  A 318 ( 3.8A)
None
FMT  A 613 ( 4.6A)
FMT  A 613 (-3.6A)
 1.42A 4qvyH-6cczA:
undetectable
4qvyN-6cczA:
undetectable		 4qvyH-6cczA:
16.59
4qvyN-6cczA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QW1_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 6ccz SERINE
HYDROXYMETHYLTRANSFE
RASE
(Medicago
truncatula) 		5 / 11 HIS A 209
SER A 211
THR A 313
THR A 314
THR A 315
 LLP  A 318 (-3.5A)
LLP  A 318 ( 3.8A)
None
FMT  A 613 ( 4.6A)
FMT  A 613 (-3.6A)
 1.40A 4qw1V-6cczA:
undetectable
4qw1b-6cczA:
undetectable		 4qw1V-6cczA:
16.59
4qw1b-6cczA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QW1_K_BO2K301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 4rmf ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycolicibacteriu
m
smegmatis) 		5 / 11 ALA A 446
GLY A 485
GLY A 486
ALA A 473
SER A 471
 None
3SY  A 701 ( 3.3A)
FMT  A 702 (-3.2A)
None
None
 1.04A 4qw1K-4rmfA:
undetectable
4qw1L-4rmfA:
undetectable		 4qw1K-4rmfA:
16.55
4qw1L-4rmfA:
15.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QW1_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 6ccz SERINE
HYDROXYMETHYLTRANSFE
RASE
(Medicago
truncatula) 		5 / 11 HIS A 209
SER A 211
THR A 313
THR A 314
THR A 315
 LLP  A 318 (-3.5A)
LLP  A 318 ( 3.8A)
None
FMT  A 613 ( 4.6A)
FMT  A 613 (-3.6A)
 1.40A 4qw1H-6cczA:
undetectable
4qw1N-6cczA:
undetectable		 4qw1H-6cczA:
16.59
4qw1N-6cczA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4R29_C_SAMC301_0
(UNCHARACTERIZED
PROTEIN)		 3lcr TAUTOMYCETIN
BIOSYNTHETIC PKS
(Streptomyces
sp.
CK4412) 		5 / 12 ARG A 224
SER A 132
GLY A 135
ALA A 243
TYR A 222
 None
FMT  A3613 (-3.0A)
None
None
None
 1.18A 4r29C-3lcrA:
undetectable		 4r29C-3lcrA:
20.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4R29_C_SAMC301_0
(UNCHARACTERIZED
PROTEIN)		 3rxy NIF3 PROTEIN
(Sphaerobacter
thermophilus) 		5 / 12 ARG A 105
GLY A 101
ALA A 210
GLY A 206
GLU A 229
 FMT  A 279 ( 3.8A)
None
None
None
None
 1.27A 4r29C-3rxyA:
undetectable		 4r29C-3rxyA:
20.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4R38_A_RBFA201_2
(BLUE-LIGHT-ACTIVATED
HISTIDINE KINASE 2)		 4isa UDP-3-O-[3-HYDROXYMY
RISTOYL]
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Escherichia
coli) 		4 / 8 ILE A 244
ASN A 253
ILE A 120
PHE A 182
 None
FMT  A 420 (-3.7A)
None
None
 0.78A 4r38A-4isaA:
undetectable		 4r38A-4isaA:
18.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4R38_C_RBFC201_2
(BLUE-LIGHT-ACTIVATED
HISTIDINE KINASE 2)		 4isa UDP-3-O-[3-HYDROXYMY
RISTOYL]
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Escherichia
coli) 		5 / 9 ILE A 244
ASN A 253
LEU A  87
ILE A 120
PHE A 182
 None
FMT  A 420 (-3.7A)
None
None
None
 1.26A 4r38C-4isaA:
undetectable		 4r38C-4isaA:
18.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4R7L_A_SHHA709_1
(LEUKOTRIENE A-4
HYDROLASE)		 3gip N-ACYL-D-GLUTAMATE
DEACYLASE
(Bordetella
bronchiseptica) 		5 / 12 TYR A 343
HIS A 218
GLU A 222
HIS A 248
TYR A 190
 FMT  A 483 (-4.4A)
ZN  A 484 ( 3.0A)
None
ZN  A 484 (-3.3A)
ACY  A 481 (-4.6A)
 1.44A 4r7lA-3gipA:
undetectable		 4r7lA-3gipA:
18.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4R87_E_SPME202_1
(SPERMIDINE
N1-ACETYLTRANSFERASE)		 3gjy SPERMIDINE SYNTHASE
(Corynebacterium
glutamicum) 		4 / 5 GLU A 121
GLU A  27
TYR A  28
GLU A 117
 None
None
None
FMT  A 315 (-3.6A)
 1.49A 4r87E-3gjyA:
1.4		 4r87E-3gjyA:
21.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RDX_A_HISA502_0
(HISTIDINE--TRNA
LIGASE)		 5kob PEPTIDE DEFORMYLASE
(Paraburkholderia
xenovorans) 		5 / 7 GLU A 142
ARG A  68
TYR A  69
GLY A  44
GLY A  46
 FE2  A 201 ( 4.2A)
None
FMT  A 202 ( 4.1A)
FMT  A 203 (-3.2A)
FMT  A 203 ( 4.9A)
 1.37A 4rdxA-5kobA:
undetectable		 4rdxA-5kobA:
16.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RTB_A_SAMA501_1
(HYDG PROTEIN)		 5hqb ALPHA-GLUCOSIDASE
(Pseudoalteromona
s
sp.
K8) 		3 / 3 GLU A 132
ARG A 130
GLN A  79
 None
None
FMT  A 714 (-3.2A)
 0.93A 4rtbA-5hqbA:
6.8		 4rtbA-5hqbA:
21.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RTP_A_SAMA301_0
(DNA ADENINE
METHYLASE)		 3kyz SENSOR PROTEIN PFES
(Pseudomonas
aeruginosa) 		5 / 12 PHE A  69
GLY A  65
ALA A  64
SER A  93
TYR A  50
 FMT  A 150 ( 4.6A)
None
None
None
None
 1.20A 4rtpA-3kyzA:
undetectable		 4rtpA-3kyzA:
17.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RTS_A_SAMA301_0
(DNA ADENINE
METHYLASE)		 5gzt CHITINASE
(Paenibacillus
sp.
FPU-7) 		5 / 12 GLY B1142
GLY B1136
ILE B1223
SER B1225
PRO B1179
 FMT  B4007 (-3.4A)
None
None
None
None
 1.24A 4rtsA-5gztB:
undetectable		 4rtsA-5gztB:
13.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RYA_A_ACTA502_0
(ABC TRANSPORTER
SUBSTRATE BINDING
PROTEIN (SORBITOL))		 3rpw ABC TRANSPORTER
(Rhodopseudomonas
palustris) 		4 / 4 LYS A 129
ARG A 127
GLY A 130
ASP A 104
 FMT  A 371 (-3.2A)
None
None
FMT  A 371 ( 3.5A)
 1.40A 4ryaA-3rpwA:
7.8		 4ryaA-3rpwA:
25.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RYA_A_MTLA501_1
(ABC TRANSPORTER
SUBSTRATE BINDING
PROTEIN (SORBITOL))		 3pmm PUTATIVE CYTOPLASMIC
PROTEIN
(Klebsiella
pneumoniae) 		3 / 3 GLU A 244
TYR A 300
GLU A 373
 FMT  A 382 ( 4.2A)
None
None
 0.70A 4ryaA-3pmmA:
undetectable		 4ryaA-3pmmA:
22.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RZV_B_032B801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 3kmv ALPHA-L-ARABINOFURAN
OSIDASE B
(Ruminiclostridiu
m
thermocellum) 		4 / 5 ILE A 118
PHE A  28
SER A 110
ASP A  76
 None
FMT  A 162 (-3.8A)
None
CA  A 163 (-3.2A)
 1.42A 4rzvB-3kmvA:
undetectable		 4rzvB-3kmvA:
19.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4TWD_C_377C401_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		4 / 6 TYR A 229
ASN A 232
TYR A 201
PHE A 283
 None
None
FMT  A 501 (-3.3A)
FMT  A 501 (-3.1A)
 1.23A 4twdB-4kv7A:
undetectable
4twdC-4kv7A:
undetectable		 4twdB-4kv7A:
21.68
4twdC-4kv7A:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4TWD_C_377C402_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		4 / 5 TYR A 229
ASN A 232
TYR A 201
PHE A 283
 None
None
FMT  A 501 (-3.3A)
FMT  A 501 (-3.1A)
 1.27A 4twdC-4kv7A:
undetectable
4twdD-4kv7A:
undetectable		 4twdC-4kv7A:
21.68
4twdD-4kv7A:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4TWD_E_377E401_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		4 / 6 TYR A 229
ASN A 232
TYR A 201
PHE A 283
 None
None
FMT  A 501 (-3.3A)
FMT  A 501 (-3.1A)
 1.20A 4twdD-4kv7A:
undetectable
4twdE-4kv7A:
undetectable		 4twdD-4kv7A:
21.68
4twdE-4kv7A:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4TWD_H_377H401_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		4 / 6 TYR A 229
ASN A 232
TYR A 201
PHE A 283
 None
None
FMT  A 501 (-3.3A)
FMT  A 501 (-3.1A)
 1.23A 4twdG-4kv7A:
undetectable
4twdH-4kv7A:
undetectable		 4twdG-4kv7A:
21.68
4twdH-4kv7A:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4TWD_J_377J401_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		4 / 6 TYR A 229
ASN A 232
TYR A 201
PHE A 283
 None
None
FMT  A 501 (-3.3A)
FMT  A 501 (-3.1A)
 1.25A 4twdI-4kv7A:
undetectable
4twdJ-4kv7A:
undetectable		 4twdI-4kv7A:
21.68
4twdJ-4kv7A:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4TYJ_A_0LIA801_1
(FIBROBLAST GROWTH
FACTOR RECEPTOR 4)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		7 / 12 ALA A  50
GLU A  66
ALA A 100
HIS A 149
LEU A 158
ALA A 172
ASP A 173
 6A7  A 401 (-3.3A)
FMT  A 404 ( 4.2A)
6A7  A 401 (-3.7A)
FMT  A 403 (-4.6A)
6A7  A 401 (-4.8A)
6A7  A 401 ( 4.1A)
FMT  A 403 ( 3.3A)
 1.11A 4tyjA-5idnA:
21.4		 4tyjA-5idnA:
24.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UBS_A_DIFA503_1
(PENTALENIC ACID
SYNTHASE)		 1yle ARGININE
N-SUCCINYLTRANSFERAS
E, ALPHA CHAIN
(Pseudomonas
aeruginosa) 		4 / 7 THR A 236
LEU A 146
LEU A 147
ILE A 239
 FMT  A 601 (-4.3A)
None
None
None
 0.77A 4ubsA-1yleA:
undetectable		 4ubsA-1yleA:
23.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UCK_B_SAMB2409_0
(RNA-DIRECTED RNA
POLYMERASE L)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		5 / 12 THR A  51
GLY A 204
ASP A 774
ALA A 781
THR A 782
 FMT  A1798 ( 4.6A)
FMT  A1798 (-3.7A)
None
None
None
 1.12A 4uckB-2c4mA:
undetectable		 4uckB-2c4mA:
19.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UHX_A_LZUA3008_1
(ALDEHYDE OXIDASE)		 5kob PEPTIDE DEFORMYLASE
(Paraburkholderia
xenovorans) 		4 / 8 HIS A 145
GLU A 142
ASP A 144
ARG A 154
 FE2  A 201 (-3.4A)
FE2  A 201 ( 4.2A)
FMT  A 204 (-3.7A)
None
 1.16A 4uhxA-5kobA:
undetectable		 4uhxA-5kobA:
8.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UHX_A_RTZA3009_1
(ALDEHYDE OXIDASE)		 5kob PEPTIDE DEFORMYLASE
(Paraburkholderia
xenovorans) 		4 / 8 HIS A 145
GLU A 142
ASP A 144
ARG A 154
 FE2  A 201 (-3.4A)
FE2  A 201 ( 4.2A)
FMT  A 204 (-3.7A)
None
 1.16A 4uhxA-5kobA:
undetectable		 4uhxA-5kobA:
8.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4URO_C_NOVC2000_1
(DNA GYRASE SUBUNIT B)		 3rpw ABC TRANSPORTER
(Rhodopseudomonas
palustris) 		5 / 12 GLU A 247
ILE A 251
PRO A 250
ASP A 145
ILE A 226
 FMT  A 375 ( 4.8A)
None
None
None
None
 1.28A 4uroC-3rpwA:
undetectable		 4uroC-3rpwA:
19.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UW0_A_SAMA1506_0
(WBDD)		 4hes BETA-LACTAMASE CLASS
A-LIKE PROTEIN
(Veillonella
parvula) 		5 / 12 GLY A 260
ALA A 257
GLU A 268
LEU A 242
ILE A 231
 None
FMT  A 304 ( 4.0A)
None
None
None
 1.10A 4uw0A-4hesA:
undetectable		 4uw0A-4hesA:
19.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UXQ_A_0LIA1752_1
(FIBROBLAST GROWTH
FACTOR RECEPTOR 4)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		5 / 12 ALA A  50
LEU A 142
HIS A 149
LEU A 158
ALA A 172
 6A7  A 401 (-3.3A)
None
FMT  A 403 (-4.6A)
6A7  A 401 (-4.8A)
6A7  A 401 ( 4.1A)
 0.41A 4uxqA-5idnA:
15.3		 4uxqA-5idnA:
24.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V01_A_0LIA1776_1
(FIBROBLAST GROWTH
FACTOR RECEPTOR 1
(FMS-RELATED
TYROSINE KINASE 2,
PFEIFFER SYNDROME),
ISOFORM CRA_B)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		5 / 12 ALA A  50
ALA A 100
LEU A 142
HIS A 149
ALA A 172
 6A7  A 401 (-3.3A)
6A7  A 401 (-3.7A)
None
FMT  A 403 (-4.6A)
6A7  A 401 ( 4.1A)
 0.54A 4v01A-5idnA:
13.7		 4v01A-5idnA:
26.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V01_A_0LIA1776_2
(FIBROBLAST GROWTH
FACTOR RECEPTOR 1
(FMS-RELATED
TYROSINE KINASE 2,
PFEIFFER SYNDROME),
ISOFORM CRA_B)		 6fek PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE RECEPTOR RET
(Homo
sapiens) 		7 / 9 LEU A 730
VAL A 738
ILE A 788
TYR A 806
ARG A 873
LEU A 881
ILE A 890
 ADN  A1104 ( 4.0A)
ADN  A1104 (-4.4A)
ADN  A1104 ( 4.7A)
ADN  A1104 ( 4.1A)
FMT  A1101 (-2.8A)
ADN  A1104 (-4.3A)
None
 0.98A 4v01A-6fekA:
32.6		 4v01A-6fekA:
18.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V01_B_0LIB1770_1
(FIBROBLAST GROWTH
FACTOR RECEPTOR 1
(FMS-RELATED
TYROSINE KINASE 2,
PFEIFFER SYNDROME),
ISOFORM CRA_B)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		5 / 12 ALA A  50
ALA A 100
LEU A 142
HIS A 149
ALA A 172
 6A7  A 401 (-3.3A)
6A7  A 401 (-3.7A)
None
FMT  A 403 (-4.6A)
6A7  A 401 ( 4.1A)
 0.48A 4v01B-5idnA:
7.4		 4v01B-5idnA:
26.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V04_A_0LIA1772_1
(FIBROBLAST GROWTH
FACTOR RECEPTOR 1
(FMS-RELATED
TYROSINE KINASE 2,
PFEIFFER SYNDROME),
ISOFORM CRA_B)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		7 / 12 VAL A  35
ALA A  50
GLU A  66
ALA A 100
HIS A 149
ALA A 172
GLY A 175
 6A7  A 401 ( 4.5A)
6A7  A 401 (-3.3A)
FMT  A 404 ( 4.2A)
6A7  A 401 (-3.7A)
FMT  A 403 (-4.6A)
6A7  A 401 ( 4.1A)
FMT  A 404 ( 4.3A)
 1.41A 4v04A-5idnA:
15.5		 4v04A-5idnA:
26.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V04_A_0LIA1772_1
(FIBROBLAST GROWTH
FACTOR RECEPTOR 1
(FMS-RELATED
TYROSINE KINASE 2,
PFEIFFER SYNDROME),
ISOFORM CRA_B)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		7 / 12 VAL A  35
ALA A  50
GLU A  66
ALA A 100
LEU A 142
HIS A 149
ALA A 172
 6A7  A 401 ( 4.5A)
6A7  A 401 (-3.3A)
FMT  A 404 ( 4.2A)
6A7  A 401 (-3.7A)
None
FMT  A 403 (-4.6A)
6A7  A 401 ( 4.1A)
 0.81A 4v04A-5idnA:
15.5		 4v04A-5idnA:
26.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V04_A_0LIA1772_2
(FIBROBLAST GROWTH
FACTOR RECEPTOR 1
(FMS-RELATED
TYROSINE KINASE 2,
PFEIFFER SYNDROME),
ISOFORM CRA_B)		 6fek PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE RECEPTOR RET
(Homo
sapiens) 		5 / 8 ILE A 788
TYR A 806
ARG A 873
LEU A 881
ILE A 890
 ADN  A1104 ( 4.7A)
ADN  A1104 ( 4.1A)
FMT  A1101 (-2.8A)
ADN  A1104 (-4.3A)
None
 1.37A 4v04A-6fekA:
32.7		 4v04A-6fekA:
18.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V04_B_0LIB1771_1
(FIBROBLAST GROWTH
FACTOR RECEPTOR 1
(FMS-RELATED
TYROSINE KINASE 2,
PFEIFFER SYNDROME),
ISOFORM CRA_B)		 6fek PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE RECEPTOR RET
(Homo
sapiens) 		7 / 10 LEU A 730
VAL A 738
ILE A 788
TYR A 806
ARG A 873
LEU A 881
ILE A 890
 ADN  A1104 ( 4.0A)
ADN  A1104 (-4.4A)
ADN  A1104 ( 4.7A)
ADN  A1104 ( 4.1A)
FMT  A1101 (-2.8A)
ADN  A1104 (-4.3A)
None
 1.17A 4v04B-6fekA:
33.3		 4v04B-6fekA:
18.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V04_B_0LIB1771_2
(FIBROBLAST GROWTH
FACTOR RECEPTOR 1
(FMS-RELATED
TYROSINE KINASE 2,
PFEIFFER SYNDROME),
ISOFORM CRA_B)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		6 / 12 ALA A  50
GLU A  66
ALA A 100
LEU A 142
HIS A 149
ALA A 172
 6A7  A 401 (-3.3A)
FMT  A 404 ( 4.2A)
6A7  A 401 (-3.7A)
None
FMT  A 403 (-4.6A)
6A7  A 401 ( 4.1A)
 0.78A 4v04B-5idnA:
15.6		 4v04B-5idnA:
26.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V2G_B_CTCB222_0
(TETRACYCLINE
REPRESSOR PROTEIN
CLASS D)		 5odo ISOMERASE
(Rhodococcus
erythropolis) 		5 / 12 HIS A 401
HIS A 399
ARG A  76
ILE A 233
SER A 225
 None
None
FMT  A 607 (-3.6A)
None
None
 1.26A 4v2gB-5odoA:
undetectable		 4v2gB-5odoA:
17.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4WNV_A_QI9A602_0
(CYTOCHROME P450 2D6)		 3rxy NIF3 PROTEIN
(Sphaerobacter
thermophilus) 		5 / 9 LEU A 102
GLU A 230
VAL A 221
VAL A 209
LEU A 242
 FMT  A 279 ( 4.5A)
None
None
None
None
 1.45A 4wnvA-3rxyA:
undetectable		 4wnvA-3rxyA:
21.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4X1K_B_LOCB502_1
(TUBULIN ALPHA CHAIN
TUBULIN BETA CHAIN)		 4rn7 N-ACETYLMURAMOYL-L-A
LANINE AMIDASE
(Clostridioides
difficile) 		5 / 12 SER A 193
VAL A 165
ALA A 180
THR A 118
ALA A 257
 None
None
None
FMT  A 406 ( 3.7A)
None
 1.26A 4x1kA-4rn7A:
undetectable
4x1kB-4rn7A:
3.9		 4x1kA-4rn7A:
18.89
4x1kB-4rn7A:
18.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4X5I_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 2qfq 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Escherichia
coli) 		3 / 3 ASP A  48
ARG A 344
ARG A 124
 None
FMT  A 601 (-2.6A)
FMT  A 602 (-3.1A)
 0.86A 4x5iA-2qfqA:
undetectable		 4x5iA-2qfqA:
18.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XDQ_A_BEZA306_0
(GLYCOSIDE HYDROLASE
FAMILY PROTEIN)		 6f1s CGLIIR PROTEIN
(Corynebacterium
glutamicum) 		3 / 3 ARG A 593
ASP A 498
TRP A 615
 FMT  A 701 ( 4.7A)
None
None
 1.17A 4xdqA-6f1sA:
undetectable		 4xdqA-6f1sA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XE5_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)		 5v0t ALPHA,ALPHA-TREHALOS
E-PHOSPHATE SYNTHASE
(UDP-FORMING)
(Paraburkholderia
xenovorans) 		4 / 6 ILE A 310
VAL A 358
PHE A 363
THR A 365
 None
None
None
FMT  A 510 ( 4.8A)
 1.07A 4xe5A-5v0tA:
undetectable		 4xe5A-5v0tA:
19.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XI3_B_29SB601_2
(ESTROGEN RECEPTOR)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		4 / 5 LEU A 158
GLU A 165
LEU A  70
HIS A 149
 6A7  A 401 (-4.8A)
None
None
FMT  A 403 (-4.6A)
 0.96A 4xi3B-5idnA:
undetectable		 4xi3B-5idnA:
22.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XI3_D_29SD601_1
(ESTROGEN RECEPTOR)		 3o5a DIHEME CYTOCHROME C
NAPB
PERIPLASMIC NITRATE
REDUCTASE
(Cupriavidus
necator) 		5 / 12 THR B  10
LEU A 491
ARG A  76
MET A 465
LEU A 774
 None
FMT  B 139 (-4.5A)
None
None
CL  A 816 (-4.0A)
 1.26A 4xi3D-3o5aB:
undetectable		 4xi3D-3o5aB:
16.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XP4_A_COCA706_1
(DOPAMINE TRANSPORTER)		 6b1z GLUTAMATE--TRNA
LIGASE
(Elizabethkingia
anophelis) 		5 / 11 ALA A 418
VAL A 479
ASP A 478
GLY A 472
GLY A 476
 None
None
FMT  A 614 (-3.8A)
None
None
 1.19A 4xp4A-6b1zA:
undetectable		 4xp4A-6b1zA:
22.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XQE_A_AG2A505_1
(HOMOSPERMIDINE
SYNTHASE)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 12 ALA A 131
PRO A 129
SER A 200
TYR A 171
LEU A 155
 None
FMT  A 501 (-4.8A)
None
FMT  A 501 (-4.6A)
None
 1.33A 4xqeA-4kv7A:
5.1		 4xqeA-4kv7A:
23.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XQE_B_AG2B504_1
(HOMOSPERMIDINE
SYNTHASE)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 12 ALA A 131
PRO A 129
SER A 200
TYR A 171
LEU A 155
 None
FMT  A 501 (-4.8A)
None
FMT  A 501 (-4.6A)
None
 1.37A 4xqeB-4kv7A:
4.0		 4xqeB-4kv7A:
23.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XRG_B_AG2B502_1
(HOMOSPERMIDINE
SYNTHASE)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 12 ALA A 131
PRO A 129
SER A 200
TYR A 171
LEU A 155
 None
FMT  A 501 (-4.8A)
None
FMT  A 501 (-4.6A)
None
 1.36A 4xrgB-4kv7A:
5.2		 4xrgB-4kv7A:
23.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XUD_A_SAMA303_1
(CATECHOL
O-METHYLTRANSFERASE)		 4ihc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Dickeya
paradisiaca) 		3 / 3 SER A 272
GLU A 352
ASP A 250
 None
FMT  A 503 (-3.2A)
MG  A 501 ( 4.8A)
 0.76A 4xudA-4ihcA:
undetectable		 4xudA-4ihcA:
21.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Y4D_A_CFFA411_1
(ENDOTHIAPEPSIN)		 2qkd ZINC FINGER PROTEIN
ZPR1
(Mus
musculus) 		4 / 6 LEU A 338
LEU A 358
ILE A 404
PHE A 403
 None
None
FMT  A 778 (-3.9A)
None
 1.25A 4y4dA-2qkdA:
undetectable		 4y4dA-2qkdA:
20.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4YDQ_B_HFGB802_1
(PROLINE--TRNA LIGASE)		 6b3p AMY13K
([Eubacterium]
rectale) 		3 / 3 GLU A 366
THR A 224
HIS A 226
 None
FMT  A 422 ( 2.8A)
FMT  A 420 (-3.5A)
 0.83A 4ydqB-6b3pA:
undetectable		 4ydqB-6b3pA:
18.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4YIA_B_IMNB401_2
(THYROXINE-BINDING
GLOBULIN)		 1zel HYPOTHETICAL PROTEIN
RV2827C
(Mycobacterium
tuberculosis) 		3 / 3 LEU A 219
ARG A 218
ARG A 215
 None
None
FMT  A 712 (-4.8A)
 0.95A 4yiaB-1zelA:
undetectable		 4yiaB-1zelA:
8.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4YMG_B_SAMB1001_0
(PUTATIVE
SAM-DEPENDENT
O-METHYLTRANFERASE)		 2igt SAM DEPENDENT
METHYLTRANSFERASE
(Agrobacterium
fabrum) 		5 / 12 GLY A 141
TYR A 142
SER A 163
ALA A 191
ASP A 211
 None
FMT  A1013 ( 4.7A)
ACY  A1008 ( 2.6A)
SAM  A1001 (-3.6A)
SAM  A1001 (-2.8A)
 1.29A 4ymgB-2igtA:
13.9		 4ymgB-2igtA:
23.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4YP2_B_NCAB302_0
(RIBOSOME-INACTIVATIN
G PROTEIN MOMORDIN I)		 1r4p SHIGA-LIKE TOXIN
TYPE II A SUBUNIT
(Escherichia
coli) 		5 / 9 PHE A  92
TYR A 114
ALA A 166
GLU A 167
ARG A 170
 FMT  A3015 ( 4.9A)
FMT  A3015 ( 4.1A)
FMT  A3015 ( 4.9A)
None
None
 0.42A 4yp2B-1r4pA:
22.3		 4yp2B-1r4pA:
23.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4YP2_B_NCAB302_0
(RIBOSOME-INACTIVATIN
G PROTEIN MOMORDIN I)		 1r4p SHIGA-LIKE TOXIN
TYPE II A SUBUNIT
(Escherichia
coli) 		5 / 9 TYR A  77
TYR A 114
ALA A 166
GLU A 167
ARG A 170
 FMT  A3015 (-4.7A)
FMT  A3015 ( 4.1A)
FMT  A3015 ( 4.9A)
None
None
 0.52A 4yp2B-1r4pA:
22.3		 4yp2B-1r4pA:
23.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZBQ_A_DIFA601_1
(SERUM ALBUMIN)		 3ju1 ENOYL-COA
HYDRATASE/ISOMERASE
FAMILY PROTEIN
(Shewanella
oneidensis) 		5 / 11 VAL A 166
PHE A 105
LEU A  87
GLY A  82
LEU A 162
 None
FMT  A 403 (-2.8A)
None
FMT  A 403 ( 4.3A)
None
 1.34A 4zbqA-3ju1A:
0.9		 4zbqA-3ju1A:
22.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZDY_A_1YNA602_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 5txr 5-AMINOLEVULINATE
SYNTHASE,
MITOCHONDRIAL
(Saccharomyces
cerevisiae) 		3 / 3 ALA B 380
TYR B 383
PRO B 466
 None
FMT  B 604 (-4.7A)
FMT  B 603 ( 4.8A)
 0.62A 4zdyA-5txrB:
undetectable		 4zdyA-5txrB:
9.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZZB_D_ACTD403_0
(PROTON-GATED ION
CHANNEL)		 3ldu PUTATIVE METHYLASE
(Clostridioides
difficile) 		4 / 4 ILE A  87
ARG A 231
TYR A 140
GLU A 138
 None
None
FMT  A 384 (-4.9A)
None
 1.22A 4zzbD-3lduA:
undetectable		 4zzbD-3lduA:
22.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZZC_C_ACTC407_0
(PROTON-GATED ION
CHANNEL)		 5hjr NEUTRAL
ALPHA-GLUCOSIDASE AB
(Mus
musculus) 		4 / 4 ILE A 822
ILE A 801
ARG A 834
TYR A 691
 None
FMT  A1022 ( 4.4A)
FMT  A1022 (-3.6A)
None
 1.07A 4zzcC-5hjrA:
undetectable		 4zzcC-5hjrA:
17.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZZC_D_ACTD406_0
(PROTON-GATED ION
CHANNEL)		 5hjr NEUTRAL
ALPHA-GLUCOSIDASE AB
(Mus
musculus) 		4 / 4 ILE A 822
ILE A 801
ARG A 834
TYR A 691
 None
FMT  A1022 ( 4.4A)
FMT  A1022 (-3.6A)
None
 1.05A 4zzcD-5hjrA:
0.6		 4zzcD-5hjrA:
17.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZZC_E_ACTE406_0
(PROTON-GATED ION
CHANNEL)		 3ldu PUTATIVE METHYLASE
(Clostridioides
difficile) 		4 / 5 ILE A  87
ARG A 231
TYR A 140
GLU A 138
 None
None
FMT  A 384 (-4.9A)
None
 1.28A 4zzcE-3lduA:
undetectable		 4zzcE-3lduA:
22.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5A1I_A_ADNA407_1
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 2qfq 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Escherichia
coli) 		4 / 8 HIS A 385
LYS A 411
SER A  25
ASP A 313
 FMT  A 601 (-4.3A)
FMT  A 602 (-2.8A)
None
S3P  A 701 ( 2.8A)
 1.14A 5a1iA-2qfqA:
undetectable		 5a1iA-2qfqA:
23.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5A1I_A_SAMA405_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 2qfq 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Escherichia
coli) 		4 / 7 HIS A 385
LYS A 411
SER A  25
ASP A 313
 FMT  A 601 (-4.3A)
FMT  A 602 (-2.8A)
None
S3P  A 701 ( 2.8A)
 1.14A 5a1iA-2qfqA:
undetectable		 5a1iA-2qfqA:
23.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ADE_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 3ih5 ELECTRON TRANSFER
FLAVOPROTEIN
ALPHA-SUBUNIT
(Bacteroides
thetaiotaomicron) 		4 / 7 GLU A 169
VAL A  17
ARG A 101
VAL A 167
 None
None
FMT  A 218 ( 4.1A)
None
 1.33A 5adeA-3ih5A:
undetectable
5adeB-3ih5A:
undetectable		 5adeA-3ih5A:
19.58
5adeB-3ih5A:
19.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AYF_A_SAMA401_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD7)		 6b3p AMY13K
([Eubacterium]
rectale) 		5 / 11 ILE A 197
ALA A 205
GLY A 206
GLU A 207
GLY A 243
 None
None
None
None
FMT  A 417 (-3.0A)
 1.07A 5ayfA-6b3pA:
undetectable		 5ayfA-6b3pA:
19.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5B8I_C_FK5C201_1
(SERINE/THREONINE-PRO
TEIN PHOSPHATASE
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE)		 2aj7 HYPOTHETICAL PROTEIN
BH3618
(Bacillus
halodurans) 		4 / 6 LEU A 139
SER A  66
PRO A  69
PHE A  65
 None
FMT  A 157 (-3.6A)
None
None
 0.99A 5b8iA-2aj7A:
undetectable		 5b8iA-2aj7A:
19.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5B8I_C_FK5C201_1
(SERINE/THREONINE-PRO
TEIN PHOSPHATASE
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE)		 3s9j MEMBER OF DUF4221
FAMILY
(Bacteroides
vulgatus) 		4 / 6 LEU A 197
SER A 112
PRO A 113
GLU A  61
 None
FMT  A 408 (-4.3A)
FMT  A 408 ( 4.4A)
GOL  A 418 (-3.7A)
 1.29A 5b8iA-3s9jA:
undetectable		 5b8iA-3s9jA:
21.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5B8I_C_FK5C201_3
(PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE)		 4lmw GLUTATHIONE
TRANSFERASE
(Phanerochaete
chrysosporium) 		5 / 12 ARG A 104
PHE A 106
ILE A  91
LEU A  37
ILE A   6
 None
None
None
FMT  A 308 ( 4.4A)
FMT  A 308 ( 4.7A)
 1.12A 5b8iC-4lmwA:
undetectable		 5b8iC-4lmwA:
18.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5BS8_G_MFXG101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)		 2woc ADP-RIBOSYL-[DINITRO
GEN REDUCTASE]
GLYCOHYDROLASE
(Rhodospirillum
rubrum) 		4 / 7 ALA A 255
ASP A  61
GLY A  24
GLU A  28
 None
FMT  A 402 ( 4.1A)
None
MN  A 401 (-3.1A)
 0.91A 5bs8A-2wocA:
undetectable
5bs8C-2wocA:
undetectable
5bs8D-2wocA:
undetectable		 5bs8A-2wocA:
21.33
5bs8C-2wocA:
21.33
5bs8D-2wocA:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5BS8_G_MFXG101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)		 4q2b ENDO-1,4-BETA-D-GLUC
ANASE
(Pseudomonas
putida) 		5 / 7 ALA A 203
ASP A 193
ARG A 190
GLY A 358
GLU A 127
 None
None
FMT  A 405 (-3.1A)
None
None
 1.41A 5bs8A-4q2bA:
undetectable
5bs8C-4q2bA:
undetectable
5bs8D-4q2bA:
undetectable		 5bs8A-4q2bA:
21.84
5bs8C-4q2bA:
21.84
5bs8D-4q2bA:
24.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5BTF_G_GFNG101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)		 3ih5 ELECTRON TRANSFER
FLAVOPROTEIN
ALPHA-SUBUNIT
(Bacteroides
thetaiotaomicron) 		4 / 7 SER A 108
ASP A 118
ARG A 168
GLY A  95
 None
None
FMT  A 218 (-3.4A)
None
 1.04A 5btfA-3ih5A:
undetectable
5btfC-3ih5A:
undetectable
5btfD-3ih5A:
2.0		 5btfA-3ih5A:
17.78
5btfC-3ih5A:
17.78
5btfD-3ih5A:
21.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5BTG_E_LFXE101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
GGTCATGAATGACTATGCAC
GTAA)		 3kfl METHIONYL-TRNA
SYNTHETASE
(Leishmania
major) 		4 / 6 ALA A 635
ARG A 675
GLY A 673
GLU A 672
 FMT  A 823 ( 3.7A)
None
None
None
 0.95A 5btgA-3kflA:
undetectable
5btgB-3kflA:
undetectable
5btgC-3kflA:
undetectable		 5btgA-3kflA:
21.73
5btgB-3kflA:
19.85
5btgC-3kflA:
21.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5BTG_F_LFXF101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)		 2woc ADP-RIBOSYL-[DINITRO
GEN REDUCTASE]
GLYCOHYDROLASE
(Rhodospirillum
rubrum) 		4 / 7 ALA A 255
ASP A  61
GLY A  24
GLU A  28
 None
FMT  A 402 ( 4.1A)
None
MN  A 401 (-3.1A)
 0.91A 5btgA-2wocA:
undetectable
5btgC-2wocA:
undetectable
5btgD-2wocA:
undetectable		 5btgA-2wocA:
21.33
5btgC-2wocA:
21.33
5btgD-2wocA:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5BVW_A_1N1A1009_1
(EPITHELIAL DISCOIDIN
DOMAIN-CONTAINING
RECEPTOR 1)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		8 / 12 VAL A  35
ALA A  50
LYS A  52
GLU A  66
ILE A  79
TYR A  99
LEU A 158
ALA A 172
 6A7  A 401 ( 4.5A)
6A7  A 401 (-3.3A)
6A7  A 401 ( 2.9A)
FMT  A 404 ( 4.2A)
6A7  A 401 (-4.2A)
6A7  A 401 (-4.9A)
6A7  A 401 (-4.8A)
6A7  A 401 ( 4.1A)
 0.81A 5bvwA-5idnA:
20.9		 5bvwA-5idnA:
26.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5C0O_F_SAMF301_0
(TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
TRMI)		 6c5b METHYLTRANSFERASE
(Lysobacter
antibioticus) 		5 / 12 THR A 159
GLY A 184
GLY A 186
LEU A 188
LEU A 249
 SAH  A 501 (-3.0A)
SAH  A 501 (-3.3A)
FMT  A 502 (-3.1A)
FMT  A 502 (-4.4A)
None
 0.93A 5c0oF-6c5bA:
11.6		 5c0oF-6c5bA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5CDQ_E_MFXE2101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT
B,DNA GYRASE SUBUNIT
B)		 3pmm PUTATIVE CYTOPLASMIC
PROTEIN
(Klebsiella
pneumoniae) 		4 / 5 SER A 134
ARG A  97
GLY A 101
GLU A 100
 None
None
FMT  A 386 (-4.4A)
None
 1.07A 5cdqA-3pmmA:
undetectable
5cdqB-3pmmA:
undetectable
5cdqC-3pmmA:
undetectable		 5cdqA-3pmmA:
20.53
5cdqB-3pmmA:
19.44
5cdqC-3pmmA:
20.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5CDQ_F_MFXF2101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT
B,DNA GYRASE SUBUNIT
B)		 3ih5 ELECTRON TRANSFER
FLAVOPROTEIN
ALPHA-SUBUNIT
(Bacteroides
thetaiotaomicron) 		4 / 6 SER A 108
ASP A 118
ARG A 168
GLY A  95
 None
None
FMT  A 218 (-3.4A)
None
 0.99A 5cdqA-3ih5A:
undetectable
5cdqC-3ih5A:
undetectable
5cdqD-3ih5A:
2.2		 5cdqA-3ih5A:
19.32
5cdqC-3ih5A:
19.32
5cdqD-3ih5A:
25.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5CDQ_V_MFXV2101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT
B,DNA GYRASE SUBUNIT
B)		 3pmm PUTATIVE CYTOPLASMIC
PROTEIN
(Klebsiella
pneumoniae) 		4 / 5 SER A 134
ARG A  97
GLY A 101
GLU A 100
 None
None
FMT  A 386 (-4.4A)
None
 1.08A 5cdqR-3pmmA:
undetectable
5cdqS-3pmmA:
undetectable
5cdqT-3pmmA:
undetectable		 5cdqR-3pmmA:
20.53
5cdqS-3pmmA:
19.44
5cdqT-3pmmA:
20.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5CF9_B_NCAB302_0
(RIBOSOME-INACTIVATIN
G PROTEIN MOMORDIN I)		 1r4p SHIGA-LIKE TOXIN
TYPE II A SUBUNIT
(Escherichia
coli) 		5 / 9 PHE A  92
TYR A 114
ALA A 166
GLU A 167
ARG A 170
 FMT  A3015 ( 4.9A)
FMT  A3015 ( 4.1A)
FMT  A3015 ( 4.9A)
None
None
 0.40A 5cf9B-1r4pA:
23.3		 5cf9B-1r4pA:
23.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5CF9_B_NCAB302_0
(RIBOSOME-INACTIVATIN
G PROTEIN MOMORDIN I)		 1r4p SHIGA-LIKE TOXIN
TYPE II A SUBUNIT
(Escherichia
coli) 		5 / 9 TYR A  77
TYR A 114
ALA A 166
GLU A 167
ARG A 170
 FMT  A3015 (-4.7A)
FMT  A3015 ( 4.1A)
FMT  A3015 ( 4.9A)
None
None
 0.52A 5cf9B-1r4pA:
23.3		 5cf9B-1r4pA:
23.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5D0X_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 6ccz SERINE
HYDROXYMETHYLTRANSFE
RASE
(Medicago
truncatula) 		5 / 11 HIS A 209
SER A 211
THR A 313
THR A 314
THR A 315
 LLP  A 318 (-3.5A)
LLP  A 318 ( 3.8A)
None
FMT  A 613 ( 4.6A)
FMT  A 613 (-3.6A)
 1.43A 5d0xV-6cczA:
undetectable
5d0xb-6cczA:
undetectable		 5d0xV-6cczA:
16.59
5d0xb-6cczA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5D0X_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 6ccz SERINE
HYDROXYMETHYLTRANSFE
RASE
(Medicago
truncatula) 		5 / 11 HIS A 209
SER A 211
THR A 313
THR A 314
THR A 315
 LLP  A 318 (-3.5A)
LLP  A 318 ( 3.8A)
None
FMT  A 613 ( 4.6A)
FMT  A 613 (-3.6A)
 1.43A 5d0xH-6cczA:
undetectable
5d0xN-6cczA:
undetectable		 5d0xH-6cczA:
16.59
5d0xN-6cczA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5DLV_B_5D5B927_1
(ECTONUCLEOTIDE
PYROPHOSPHATASE/PHOS
PHODIESTERASE FAMILY
MEMBER 2)		 2igt SAM DEPENDENT
METHYLTRANSFERASE
(Agrobacterium
fabrum) 		4 / 7 TYR A 253
PHE A 113
HIS A 119
TRP A 120
 SAM  A1001 (-4.7A)
FMT  A1013 ( 3.5A)
None
None
 1.24A 5dlvB-2igtA:
undetectable		 5dlvB-2igtA:
17.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5DZK_1_BEZ1801_0
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 1
ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 2
BEZ-LEU-LEU)		 2poe CYCLOPHILIN-LIKE
PROTEIN, PUTATIVE
(Cryptosporidium
parvum) 		3 / 3 LEU A 103
PHE A  33
ILE A 102
 None
FMT  A 204 ( 4.4A)
FMT  A 201 (-4.9A)
 0.63A 5dzk1-2poeA:
undetectable
5dzkF-2poeA:
undetectable
5dzkM-2poeA:
undetectable		 5dzk1-2poeA:
0.54
5dzkF-2poeA:
21.96
5dzkM-2poeA:
21.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5DZK_R_BEZR801_0
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 2
BEZ-LEU-LEU)		 5gzt CHITINASE
(Paenibacillus
sp.
FPU-7) 		4 / 7 PHE B1197
SER B1144
ALA B1147
PRO B1179
 None
FMT  B4007 (-4.8A)
None
None
 0.94A 5dzkD-5gztB:
1.9
5dzkR-5gztB:
undetectable		 5dzkD-5gztB:
11.94
5dzkR-5gztB:
3.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5DZK_R_BEZR801_1
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 2
BEZ-LEU-LEU)		 5gzt CHITINASE
(Paenibacillus
sp.
FPU-7) 		4 / 8 PHE B1197
SER B1144
ALA B1147
PRO B1179
 None
FMT  B4007 (-4.8A)
None
None
 0.95A 5dzkd-5gztB:
1.6
5dzkr-5gztB:
undetectable		 5dzkd-5gztB:
11.94
5dzkr-5gztB:
3.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5DZK_T_BEZT801_1
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 2
BEZ-LEU-LEU)		 5gzt CHITINASE
(Paenibacillus
sp.
FPU-7) 		4 / 8 PHE B1197
SER B1144
ALA B1147
PRO B1179
 None
FMT  B4007 (-4.8A)
None
None
 0.94A 5dzkF-5gztB:
1.6
5dzkT-5gztB:
undetectable		 5dzkF-5gztB:
11.94
5dzkT-5gztB:
3.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EAJ_B_FOLB201_1
(DIHYDROFOLATE
REDUCTASE)		 2qfq 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Escherichia
coli) 		3 / 3 ASP A  48
ARG A 344
ARG A 124
 None
FMT  A 601 (-2.6A)
FMT  A 602 (-3.1A)
 0.95A 5eajB-2qfqA:
undetectable		 5eajB-2qfqA:
17.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEU_A_TRPA101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 9 SER A  56
GLY A 127
ALA A  58
THR A 106
THR A 130
 None
FMT  A 501 (-3.4A)
None
None
None
 1.28A 5eeuA-4kv7A:
undetectable
5eeuB-4kv7A:
undetectable		 5eeuA-4kv7A:
13.40
5eeuB-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEU_B_TRPB101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 9 SER A  56
GLY A 127
ALA A  58
THR A 106
THR A 130
 None
FMT  A 501 (-3.4A)
None
None
None
 1.28A 5eeuB-4kv7A:
undetectable
5eeuC-4kv7A:
undetectable		 5eeuB-4kv7A:
13.40
5eeuC-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEU_H_TRPH101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 10 SER A  56
GLY A 127
ALA A  58
THR A 106
THR A 130
 None
FMT  A 501 (-3.4A)
None
None
None
 1.27A 5eeuH-4kv7A:
undetectable
5eeuI-4kv7A:
undetectable		 5eeuH-4kv7A:
13.40
5eeuI-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEU_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 10 GLY A 127
ALA A  58
THR A 106
THR A 130
SER A  56
 FMT  A 501 (-3.4A)
None
None
None
None
 1.28A 5eeuR-4kv7A:
undetectable
5eeuS-4kv7A:
undetectable		 5eeuR-4kv7A:
13.40
5eeuS-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEV_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		4 / 8 GLY A 127
ALA A  58
THR A 106
THR A 130
 FMT  A 501 (-3.4A)
None
None
None
 0.85A 5eevL-4kv7A:
undetectable
5eevV-4kv7A:
undetectable		 5eevL-4kv7A:
13.40
5eevV-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEV_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 10 GLY A 127
ALA A  58
THR A 106
THR A 130
SER A  56
 FMT  A 501 (-3.4A)
None
None
None
None
 1.28A 5eevR-4kv7A:
undetectable
5eevS-4kv7A:
undetectable		 5eevR-4kv7A:
13.40
5eevS-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEW_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		4 / 8 GLY A 127
ALA A  58
THR A 106
THR A 130
 FMT  A 501 (-3.4A)
None
None
None
 0.85A 5eewL-4kv7A:
undetectable
5eewV-4kv7A:
undetectable		 5eewL-4kv7A:
13.40
5eewV-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEW_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 10 GLY A 127
ALA A  58
THR A 106
THR A 130
SER A  56
 FMT  A 501 (-3.4A)
None
None
None
None
 1.28A 5eewR-4kv7A:
undetectable
5eewS-4kv7A:
undetectable		 5eewR-4kv7A:
13.40
5eewS-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEX_R_TRPR101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 9 GLY A 127
ALA A  58
THR A 106
THR A 130
SER A  56
 FMT  A 501 (-3.4A)
None
None
None
None
 1.28A 5eexQ-4kv7A:
undetectable
5eexR-4kv7A:
undetectable		 5eexQ-4kv7A:
13.40
5eexR-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEX_S_TRPS101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 10 GLY A 127
ALA A  58
THR A 106
THR A 130
SER A  56
 FMT  A 501 (-3.4A)
None
None
None
None
 1.28A 5eexR-4kv7A:
undetectable
5eexS-4kv7A:
undetectable		 5eexR-4kv7A:
13.40
5eexS-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEY_R_TRPR101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 9 GLY A 127
ALA A  58
THR A 106
THR A 130
SER A  56
 FMT  A 501 (-3.4A)
None
None
None
None
 1.28A 5eeyQ-4kv7A:
undetectable
5eeyR-4kv7A:
undetectable		 5eeyQ-4kv7A:
13.40
5eeyR-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEZ_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 2wda PUTATIVE SECRETED
LYASE
(Streptomyces
violaceoruber) 		4 / 8 THR A 191
GLY A 232
HIS A 244
THR A 245
 None
PEG  A1779 (-4.4A)
FMT  A1766 (-3.9A)
None
 0.86A 5eezL-2wdaA:
0.0
5eezV-2wdaA:
undetectable		 5eezL-2wdaA:
6.68
5eezV-2wdaA:
6.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEZ_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		4 / 8 GLY A 127
ALA A  58
THR A 106
THR A 130
 FMT  A 501 (-3.4A)
None
None
None
 0.84A 5eezL-4kv7A:
undetectable
5eezV-4kv7A:
undetectable		 5eezL-4kv7A:
13.40
5eezV-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEZ_R_TRPR101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 9 GLY A 127
ALA A  58
THR A 106
THR A 130
SER A  56
 FMT  A 501 (-3.4A)
None
None
None
None
 1.28A 5eezQ-4kv7A:
undetectable
5eezR-4kv7A:
undetectable		 5eezQ-4kv7A:
13.40
5eezR-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EF0_R_TRPR101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 9 GLY A 127
ALA A  58
THR A 106
THR A 130
SER A  56
 FMT  A 501 (-3.4A)
None
None
None
None
 1.28A 5ef0Q-4kv7A:
undetectable
5ef0R-4kv7A:
undetectable		 5ef0Q-4kv7A:
13.40
5ef0R-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EF1_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 2wda PUTATIVE SECRETED
LYASE
(Streptomyces
violaceoruber) 		4 / 8 THR A 191
GLY A 232
HIS A 244
THR A 245
 None
PEG  A1779 (-4.4A)
FMT  A1766 (-3.9A)
None
 0.86A 5ef1L-2wdaA:
undetectable
5ef1V-2wdaA:
0.0		 5ef1L-2wdaA:
6.68
5ef1V-2wdaA:
6.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EF1_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		4 / 8 GLY A 127
ALA A  58
THR A 106
THR A 130
 FMT  A 501 (-3.4A)
None
None
None
 0.85A 5ef1L-4kv7A:
undetectable
5ef1V-4kv7A:
undetectable		 5ef1L-4kv7A:
13.40
5ef1V-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EF1_R_TRPR101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 9 GLY A 127
ALA A  58
THR A 106
THR A 130
SER A  56
 FMT  A 501 (-3.4A)
None
None
None
None
 1.28A 5ef1Q-4kv7A:
undetectable
5ef1R-4kv7A:
undetectable		 5ef1Q-4kv7A:
13.40
5ef1R-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EF2_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 2wda PUTATIVE SECRETED
LYASE
(Streptomyces
violaceoruber) 		4 / 8 THR A 191
GLY A 232
HIS A 244
THR A 245
 None
PEG  A1779 (-4.4A)
FMT  A1766 (-3.9A)
None
 0.87A 5ef2L-2wdaA:
undetectable
5ef2V-2wdaA:
undetectable		 5ef2L-2wdaA:
6.68
5ef2V-2wdaA:
6.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EF2_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		4 / 8 GLY A 127
ALA A  58
THR A 106
THR A 130
 FMT  A 501 (-3.4A)
None
None
None
 0.85A 5ef2L-4kv7A:
undetectable
5ef2V-4kv7A:
undetectable		 5ef2L-4kv7A:
13.40
5ef2V-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EF2_R_TRPR101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		5 / 9 GLY A 127
ALA A  58
THR A 106
THR A 130
SER A  56
 FMT  A 501 (-3.4A)
None
None
None
None
 1.28A 5ef2Q-4kv7A:
undetectable
5ef2R-4kv7A:
undetectable		 5ef2Q-4kv7A:
13.40
5ef2R-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EF3_L_TRPL101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4kv7 PROBABLE
LEUCINE/ISOLEUCINE/V
ALINE-BINDING
PROTEIN
(Rhodopirellula
baltica) 		4 / 8 GLY A 127
ALA A  58
THR A 106
THR A 130
 FMT  A 501 (-3.4A)
None
None
None
 0.85A 5ef3L-4kv7A:
undetectable
5ef3V-4kv7A:
undetectable		 5ef3L-4kv7A:
13.40
5ef3V-4kv7A:
13.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EWZ_B_BEZB301_0
(14-3-3 PROTEIN
ZETA/DELTA)		 5umu FACT COMPLEX SUBUNIT
SPT16
(Homo
sapiens) 		3 / 3 MET A 676
GLN A 677
ARG A 675
 None
None
FMT  A1009 ( 4.6A)
 1.12A 5ewzB-5umuA:
undetectable		 5ewzB-5umuA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5F9Z_A_HFGA702_0
(AMINOACYL-TRNA
SYNTHETASE)		 3lqn CBS DOMAIN PROTEIN
(Bacillus
anthracis) 		5 / 12 LEU A  51
GLY A 127
PHE A 115
SER A  46
GLY A  44
 FMT  A 169 ( 4.9A)
None
None
None
FMT  A 167 (-3.6A)
 1.33A 5f9zA-3lqnA:
undetectable		 5f9zA-3lqnA:
14.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5FHZ_C_REAC602_1
(ALDEHYDE
DEHYDROGENASE FAMILY
1 MEMBER A3)		 2fsr ACETYLTRANSFERASE
(Agrobacterium
fabrum) 		5 / 10 ILE A  80
GLY A  78
LEU A  97
LEU A  13
LEU A  70
 None
None
None
None
FMT  A 301 (-4.6A)
 1.21A 5fhzC-2fsrA:
undetectable		 5fhzC-2fsrA:
15.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5FHZ_D_READ602_1
(ALDEHYDE
DEHYDROGENASE FAMILY
1 MEMBER A3)		 2qfq 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Escherichia
coli) 		5 / 12 ILE A  75
GLU A  74
ARG A  72
ASN A  55
LEU A  44
 None
FMT  A 605 ( 4.8A)
FMT  A 605 (-4.0A)
None
None
 1.39A 5fhzD-2qfqA:
undetectable		 5fhzD-2qfqA:
21.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5G0P_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 3ih5 ELECTRON TRANSFER
FLAVOPROTEIN
ALPHA-SUBUNIT
(Bacteroides
thetaiotaomicron) 		4 / 7 GLU A 169
VAL A  17
ARG A 101
VAL A 167
 None
None
FMT  A 218 ( 4.1A)
None
 1.34A 5g0pA-3ih5A:
undetectable
5g0pB-3ih5A:
undetectable		 5g0pA-3ih5A:
19.58
5g0pB-3ih5A:
19.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5GHY_A_CEDA301_1
(BETA-LACTAMASE)		 1k38 BETA-LACTAMASE OXA-2
(Salmonella
enterica) 		6 / 12 ALA A  66
SER A  67
SER A 115
LYS A 205
GLY A 207
ARG A 244
 None
KCX  A  70 ( 2.7A)
FMT  A 401 (-2.4A)
FMT  A 401 ( 3.8A)
FMT  A 401 (-3.6A)
FMT  A 401 (-2.6A)
 0.66A 5ghyA-1k38A:
19.4		 5ghyA-1k38A:
24.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5GHY_A_CEDA301_1
(BETA-LACTAMASE)		 5kzh BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 12 ALA A  79
SER A  80
SER A 127
LYS A 217
GLY A 219
ARG A 260
 FMT  A 301 (-3.2A)
FMT  A 301 (-2.5A)
FMT  A 301 (-3.3A)
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
 0.62A 5ghyA-5kzhA:
19.9		 5ghyA-5kzhA:
23.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5GHY_B_CEDB301_1
(BETA-LACTAMASE)		 1k38 BETA-LACTAMASE OXA-2
(Salmonella
enterica) 		6 / 12 ALA A  66
SER A  67
SER A 115
LYS A 205
GLY A 207
ARG A 244
 None
KCX  A  70 ( 2.7A)
FMT  A 401 (-2.4A)
FMT  A 401 ( 3.8A)
FMT  A 401 (-3.6A)
FMT  A 401 (-2.6A)
 0.66A 5ghyB-1k38A:
19.4		 5ghyB-1k38A:
24.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5GHY_B_CEDB301_1
(BETA-LACTAMASE)		 5kzh BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 12 ALA A  79
SER A  80
SER A 127
LYS A 217
GLY A 219
ARG A 260
 FMT  A 301 (-3.2A)
FMT  A 301 (-2.5A)
FMT  A 301 (-3.3A)
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
 0.63A 5ghyB-5kzhA:
19.9		 5ghyB-5kzhA:
23.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5GHZ_A_CEDA301_1
(BETA-LACTAMASE)		 1k38 BETA-LACTAMASE OXA-2
(Salmonella
enterica) 		7 / 11 ALA A  66
SER A  67
SER A 115
LYS A 205
THR A 206
GLY A 207
ARG A 244
 None
KCX  A  70 ( 2.7A)
FMT  A 401 (-2.4A)
FMT  A 401 ( 3.8A)
FMT  A 401 (-3.7A)
FMT  A 401 (-3.6A)
FMT  A 401 (-2.6A)
 0.63A 5ghzA-1k38A:
19.3		 5ghzA-1k38A:
24.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5GHZ_A_CEDA301_1
(BETA-LACTAMASE)		 5kzh BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 11 ALA A  79
SER A  80
SER A 127
LYS A 217
GLY A 219
ARG A 260
 FMT  A 301 (-3.2A)
FMT  A 301 (-2.5A)
FMT  A 301 (-3.3A)
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
 0.60A 5ghzA-5kzhA:
19.7		 5ghzA-5kzhA:
23.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5GHZ_B_CEDB301_1
(BETA-LACTAMASE)		 1k38 BETA-LACTAMASE OXA-2
(Salmonella
enterica) 		7 / 10 ALA A  66
SER A  67
SER A 115
LYS A 205
THR A 206
GLY A 207
ARG A 244
 None
KCX  A  70 ( 2.7A)
FMT  A 401 (-2.4A)
FMT  A 401 ( 3.8A)
FMT  A 401 (-3.7A)
FMT  A 401 (-3.6A)
FMT  A 401 (-2.6A)
 0.63A 5ghzB-1k38A:
19.3		 5ghzB-1k38A:
24.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5GHZ_B_CEDB301_1
(BETA-LACTAMASE)		 5kzh BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 10 ALA A  79
SER A  80
SER A 127
LYS A 217
GLY A 219
ARG A 260
 FMT  A 301 (-3.2A)
FMT  A 301 (-2.5A)
FMT  A 301 (-3.3A)
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
 0.60A 5ghzB-5kzhA:
19.7		 5ghzB-5kzhA:
23.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HES_A_032A401_1
(MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE KINASE MLT)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		6 / 12 VAL A  35
ALA A  50
ILE A  79
TYR A  99
ALA A 100
GLY A 175
 6A7  A 401 ( 4.5A)
6A7  A 401 (-3.3A)
6A7  A 401 (-4.2A)
6A7  A 401 (-4.9A)
6A7  A 401 (-3.7A)
FMT  A 404 ( 4.3A)
 0.97A 5hesA-5idnA:
7.2		 5hesA-5idnA:
27.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HES_B_032B401_1
(MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE KINASE MLT)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		6 / 12 VAL A  35
ALA A  50
LYS A  52
TYR A  99
ALA A 100
GLY A 175
 6A7  A 401 ( 4.5A)
6A7  A 401 (-3.3A)
6A7  A 401 ( 2.9A)
6A7  A 401 (-4.9A)
6A7  A 401 (-3.7A)
FMT  A 404 ( 4.3A)
 0.99A 5hesB-5idnA:
21.2		 5hesB-5idnA:
27.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HI2_A_BAXA801_1
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		6 / 12 ALA A  50
LYS A  52
GLU A  66
LEU A  70
LEU A 142
HIS A 149
 6A7  A 401 (-3.3A)
6A7  A 401 ( 2.9A)
FMT  A 404 ( 4.2A)
None
None
FMT  A 403 (-4.6A)
 0.83A 5hi2A-5idnA:
12.4		 5hi2A-5idnA:
24.87
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5HSW_A_ACTA501_0
(ORF 37)		 3pov ORF 37
(Human
gammaherpesvirus
8) 		4 / 5 SER A 144
SER A 145
SER A 146
SER A 219
 FMT  A 489 ( 4.6A)
FMT  A 489 (-2.5A)
None
None
 0.64A 5hswA-3povA:
53.5		 5hswA-3povA:
99.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HWA_A_GCSA301_1
(CHITOSANASE)		 3ed5 YFNB
(Bacillus
subtilis) 		4 / 8 GLN A 100
ASP A  12
GLY A  98
LEU A  24
 None
FMT  A 244 (-3.9A)
None
FMT  A 242 (-4.1A)
 0.97A 5hwaA-3ed5A:
undetectable		 5hwaA-3ed5A:
24.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HWK_A_BEZA301_0
(GLUTATHIONE-SPECIFIC
GAMMA-GLUTAMYLCYCLOT
RANSFERASE)		 3w2x EXODEOXYRIBONUCLEASE
(Methanothermobac
ter
thermautotrophic
us) 		5 / 10 GLY A 172
SER A 171
LEU A 174
LEU A 126
TYR A 129
 None
None
FMT  A 303 ( 4.1A)
None
None
 1.02A 5hwkA-3w2xA:
undetectable		 5hwkA-3w2xA:
21.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HWK_B_BEZB301_0
(GLUTATHIONE-SPECIFIC
GAMMA-GLUTAMYLCYCLOT
RANSFERASE)		 3w2x EXODEOXYRIBONUCLEASE
(Methanothermobac
ter
thermautotrophic
us) 		5 / 10 GLY A 172
SER A 171
LEU A 174
LEU A 126
TYR A 129
 None
None
FMT  A 303 ( 4.1A)
None
None
 1.02A 5hwkB-3w2xA:
undetectable		 5hwkB-3w2xA:
21.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5I71_A_68PA701_1
(SODIUM-DEPENDENT
SEROTONIN
TRANSPORTER)		 5mrt LYTIC ENDOPEPTIDASE
PREPROENZYME
(Lysobacter
sp.
XL1) 		5 / 12 ALA A  36
GLY A 150
LEU A 163
GLY A  56
VAL A  48
 None
None
None
FMT  A 303 ( 4.4A)
None
 1.22A 5i71A-5mrtA:
undetectable		 5i71A-5mrtA:
8.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5I75_A_68PA701_1
(SODIUM-DEPENDENT
SEROTONIN
TRANSPORTER)		 5mrt LYTIC ENDOPEPTIDASE
PREPROENZYME
(Lysobacter
sp.
XL1) 		5 / 12 ALA A  36
GLY A 150
LEU A 163
GLY A  56
VAL A  48
 None
None
None
FMT  A 303 ( 4.4A)
None
 1.25A 5i75A-5mrtA:
undetectable		 5i75A-5mrtA:
8.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IKR_A_ID8A601_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 1r4p SHIGA-LIKE TOXIN
TYPE II A SUBUNIT
(Escherichia
coli) 		3 / 3 VAL A 120
LEU A  67
MET A 143
 FMT  A3010 (-4.5A)
None
None
 0.90A 5ikrA-1r4pA:
undetectable		 5ikrA-1r4pA:
18.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IMS_B_ACTB713_0
(ACETOLACTATE
SYNTHASE CATALYTIC
SUBUNIT,
MITOCHONDRIAL)		 3f5b AMINOGLYCOSIDE
N(6')ACETYLTRANSFERA
SE
(Legionella
pneumophila) 		3 / 3 GLY A 107
GLN A 111
LYS A 144
 FMT  A 186 ( 3.7A)
None
None
 0.96A 5imsB-3f5bA:
undetectable		 5imsB-3f5bA:
12.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5JKV_A_ASDA602_1
(AROMATASE)		 4qc6 BIFUNCTIONAL AAC/APH
(Staphylococcus
warneri) 		5 / 12 ILE A  70
ILE A 112
VAL A  30
LEU A  25
MET A  21
 None
30N  A 202 (-4.9A)
None
FMT  A 203 ( 4.4A)
None
 0.96A 5jkvA-4qc6A:
undetectable		 5jkvA-4qc6A:
17.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5K7U_A_SAMA601_1
(N6-ADENOSINE-METHYLT
RANSFERASE 70 KDA
SUBUNIT)		 6cwx RIBONUCLEASE P
PROTEIN SUBUNIT P20
(Homo
sapiens) 		3 / 3 ASP A  44
ASN A  83
GLN A  87
 None
FMT  A 201 (-3.9A)
None
 0.62A 5k7uA-6cwxA:
2.8		 5k7uA-6cwxA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KB6_A_ADNA401_1
(ADENOSINE KINASE)		 2is8 MOLYBDOPTERIN
BIOSYNTHESIS ENZYME,
MOAB
(Thermus
thermophilus) 		6 / 12 GLY A  70
ASP A  20
ILE A   6
ALA A 135
GLY A 134
ILE A  26
 None
FMT  A1003 (-3.7A)
None
None
None
None
 1.31A 5kb6A-2is8A:
undetectable		 5kb6A-2is8A:
18.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KB6_B_ADNB401_1
(ADENOSINE KINASE)		 2is8 MOLYBDOPTERIN
BIOSYNTHESIS ENZYME,
MOAB
(Thermus
thermophilus) 		6 / 12 GLY A  70
ASP A  20
ILE A   6
ALA A 135
GLY A 134
ILE A  26
 None
FMT  A1003 (-3.7A)
None
None
None
None
 1.29A 5kb6B-2is8A:
undetectable		 5kb6B-2is8A:
18.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KBW_B_RBFB201_1
(RIBOFLAVIN
TRANSPORTER RIBU)		 3nnm CURA
(Lyngbya
majuscula) 		5 / 12 GLU A  43
LEU A  37
ALA A 101
ASN A 100
VAL A  76
 None
None
FMT  A 750 ( 4.0A)
None
None
 1.31A 5kbwB-3nnmA:
undetectable		 5kbwB-3nnmA:
20.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KGP_A_GCSA407_1
(PREDICTED
ACETYLTRANSFERASE)		 2ymv ACG NITROREDUCTASE
(Mycolicibacteriu
m
smegmatis) 		4 / 8 ARG A  86
GLU A 254
GLY A 148
PRO A 149
 FMT  A1333 (-2.9A)
None
None
None
 0.96A 5kgpA-2ymvA:
undetectable		 5kgpA-2ymvA:
18.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KGP_B_GCSB405_1
(PREDICTED
ACETYLTRANSFERASE)		 2ymv ACG NITROREDUCTASE
(Mycolicibacteriu
m
smegmatis) 		4 / 8 ARG A  86
GLU A 254
GLY A 148
PRO A 149
 FMT  A1333 (-2.9A)
None
None
None
 0.93A 5kgpB-2ymvA:
undetectable		 5kgpB-2ymvA:
18.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KIR_B_RCXB601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3qm3 FRUCTOSE-BISPHOSPHAT
E ALDOLASE
(Campylobacter
jejuni) 		5 / 12 HIS A 102
VAL A  11
ALA A  33
GLY A  84
ALA A  85
 None
FMT  A 356 (-4.2A)
None
None
None
 1.10A 5kirB-3qm3A:
undetectable		 5kirB-3qm3A:
20.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KM9_B_ADNB201_1
(HISTIDINE TRIAD
NUCLEOTIDE-BINDING
PROTEIN 2,
MITOCHONDRIAL)		 3gip N-ACYL-D-GLUTAMATE
DEACYLASE
(Bordetella
bronchiseptica) 		5 / 12 VAL A 226
ALA A 223
SER A 287
HIS A 248
HIS A 218
 None
None
FMT  A 483 ( 2.6A)
ZN  A 484 (-3.3A)
ZN  A 484 ( 3.0A)
 1.25A 5km9B-3gipA:
undetectable		 5km9B-3gipA:
15.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KOC_B_SAMB401_0
(PAVINE
N-METHYLTRANSFERASE)		 3mg9 TEG12
(uncultured
soil
bacterium) 		5 / 12 GLY A  14
SER A  98
THR A  16
VAL A  18
LEU A  88
 None
None
FMT  A 289 ( 4.7A)
None
None
 1.13A 5kocB-3mg9A:
undetectable		 5kocB-3mg9A:
20.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KOX_A_RFPA502_2
(PENTACHLOROPHENOL
4-MONOOXYGENASE)		 4isa UDP-3-O-[3-HYDROXYMY
RISTOYL]
N-ACETYLGLUCOSAMINE
DEACETYLASE
(Escherichia
coli) 		3 / 3 VAL A  96
ARG A 190
PRO A 110
 None
None
FMT  A 410 (-4.2A)
 0.75A 5koxA-4isaA:
undetectable		 5koxA-4isaA:
22.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5LJB_A_RTLA201_1
(RETINOL-BINDING
PROTEIN 1)		 3pmm PUTATIVE CYTOPLASMIC
PROTEIN
(Klebsiella
pneumoniae) 		4 / 8 LEU A 375
LEU A  27
ILE A  89
THR A  32
 None
None
None
FMT  A 387 ( 4.5A)
 1.01A 5ljbA-3pmmA:
undetectable		 5ljbA-3pmmA:
18.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5M35_B_BEZB302_0
(14-3-3 PROTEIN
ZETA/DELTA)		 5umu FACT COMPLEX SUBUNIT
SPT16
(Homo
sapiens) 		3 / 3 MET A 676
GLN A 677
ARG A 675
 None
None
FMT  A1009 ( 4.6A)
 1.10A 5m35B-5umuA:
undetectable		 5m35B-5umuA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5M36_A_BEZA303_0
(14-3-3 PROTEIN
ZETA/DELTA)		 5umu FACT COMPLEX SUBUNIT
SPT16
(Homo
sapiens) 		3 / 3 MET A 676
GLN A 677
ARG A 675
 None
None
FMT  A1009 ( 4.6A)
 1.06A 5m36A-5umuA:
undetectable		 5m36A-5umuA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5M6G_A_SORA711_0
(BETA-GLUCOSIDASE)		 4yyf BETA-N-ACETYLHEXOSAM
INIDASE
(Mycolicibacteriu
m
smegmatis) 		5 / 12 ASP A 126
PHE A 177
LYS A 225
HIS A 226
MET A 270
 FMT  A 404 (-4.0A)
None
None
ACT  A 401 (-3.5A)
None
 0.44A 5m6gA-4yyfA:
29.4		 5m6gA-4yyfA:
23.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5MRA_B_DM2B204_1
(SORCIN)		 2cjt UNC-13 HOMOLOG A
(Rattus
norvegicus) 		4 / 6 PHE A  20
THR A  22
ASP A  72
GLY A  68
 None
None
EDO  A1134 (-2.9A)
FMT  A1137 ( 3.1A)
 1.03A 5mraA-2cjtA:
undetectable
5mraB-2cjtA:
undetectable		 5mraA-2cjtA:
23.16
5mraB-2cjtA:
23.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5MUE_A_VIVA302_0
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)		 4dgf SULFATE TRANSPORTER
SULFATE TRANSPORTER
FAMILY PROTEIN
(Wolinella
succinogenes) 		5 / 12 ILE A 459
VAL A 522
LEU A 526
VAL A 492
ILE A 495
 FMT  A 602 (-4.7A)
None
None
None
None
 0.99A 5mueA-4dgfA:
3.3		 5mueA-4dgfA:
19.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5N0X_B_SAMB501_1
(PEPTIDE
N-METHYLTRANSFERASE)		 4ihb DYSFERLIN
(Homo
sapiens) 		3 / 3 SER A 100
ALA A  99
THR A  94
 FMT  A 202 ( 4.7A)
None
None
 0.73A 5n0xB-4ihbA:
undetectable		 5n0xB-4ihbA:
16.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5NCD_D_ACTD301_0
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 3c9f 5'-NUCLEOTIDASE
(Candida
albicans) 		4 / 4 ASP A  80
HIS A 217
HIS A 249
HIS A 115
 ZN  A 601 ( 2.7A)
ZN  A 601 (-3.5A)
ZN  A 601 ( 3.4A)
FMT  A 607 (-4.0A)
 1.45A 5ncdD-3c9fA:
undetectable		 5ncdD-3c9fA:
16.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5NFJ_A_SAMA501_0
(MITOCHONDRIAL
RIBONUCLEASE P
PROTEIN 1)		 3d5e PLATELET-ACTIVATING
FACTOR
ACETYLHYDROLASE
(Homo
sapiens) 		5 / 12 LEU A 124
ALA A 360
GLY A 126
THR A 129
LEU A 371
 None
None
None
FMT  A  11 (-3.6A)
None
 1.00A 5nfjA-3d5eA:
undetectable		 5nfjA-3d5eA:
17.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5NFJ_B_SAMB501_0
(MITOCHONDRIAL
RIBONUCLEASE P
PROTEIN 1)		 3d5e PLATELET-ACTIVATING
FACTOR
ACETYLHYDROLASE
(Homo
sapiens) 		5 / 12 LEU A 124
ALA A 360
GLY A 126
THR A 129
LEU A 371
 None
None
None
FMT  A  11 (-3.6A)
None
 1.05A 5nfjB-3d5eA:
undetectable		 5nfjB-3d5eA:
17.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5NFJ_C_SAMC501_0
(MITOCHONDRIAL
RIBONUCLEASE P
PROTEIN 1)		 3d5e PLATELET-ACTIVATING
FACTOR
ACETYLHYDROLASE
(Homo
sapiens) 		5 / 12 LEU A 124
ALA A 360
GLY A 126
THR A 129
LEU A 371
 None
None
None
FMT  A  11 (-3.6A)
None
 1.06A 5nfjC-3d5eA:
undetectable		 5nfjC-3d5eA:
17.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5NWW_A_ACAA18_1
(SCRFP-TAG,GP41)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		5 / 12 LYS A 153
LEU A 205
LEU A 206
GLU A 203
LEU A 204
 FMT  A 403 ( 4.1A)
None
None
None
None
 1.16A 5nwwA-5idnA:
undetectable		 5nwwA-5idnA:
7.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ODI_A_ACTA701_0
(HETERODISULFIDE
REDUCTASE, SUBUNIT A)		 2c5a GDP-MANNOSE-3',
5'-EPIMERASE
(Arabidopsis
thaliana) 		3 / 3 LYS A 225
LYS A 357
SER A 356
 GDC  A1376 (-2.7A)
FMT  A1390 (-3.0A)
GDC  A1376 (-2.7A)
 1.35A 5odiA-2c5aA:
4.4		 5odiA-2c5aA:
21.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OV9_B_CVIB602_0
(ACETYLCHOLINESTERASE)		 2pex TRANSCRIPTIONAL
REGULATOR OHRR
(Xanthomonas
campestris) 		4 / 8 THR A  46
LEU A  40
TYR A  50
VAL A 125
 FMT  A 201 (-2.9A)
None
None
None
 1.29A 5ov9B-2pexA:
undetectable		 5ov9B-2pexA:
14.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OY0_2_PQN2843_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A2)		 4e6y CITRATE SYNTHASE
(Vibrio
vulnificus) 		5 / 12 MET A 202
PHE A 198
ILE A 369
ALA A 219
ALA A 195
 None
None
None
None
FMT  A 504 ( 4.9A)
 1.16A 5oy02-4e6yA:
undetectable		 5oy02-4e6yA:
11.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5SYI_A_NIZA805_1
(CATALASE-PEROXIDASE)		 3wkq NITRITE REDUCTASE
(Geobacillus
thermodenitrific
ans) 		4 / 5 TRP A  63
HIS A  21
ALA A  20
PRO A 115
 FMT  A 412 (-4.0A)
FMT  A 412 (-3.7A)
None
None
 1.39A 5syiA-3wkqA:
undetectable		 5syiA-3wkqA:
18.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UC1_A_486A801_1
(GLUCOCORTICOID
RECEPTOR)		 4gz2 TYROSYL-DNA
PHOSPHODIESTERASE 2
(Mus
musculus) 		5 / 12 LEU A 255
LEU A 286
GLY A 285
LEU A 275
ARG A 327
 None
None
None
None
FMT  A 401 ( 4.7A)
 1.19A 5uc1A-4gz2A:
undetectable		 5uc1A-4gz2A:
17.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UIG_A_EDTA501_0
(ADENOSINE RECEPTOR
A2A,SOLUBLE
CYTOCHROME
B562,ADENOSINE
RECEPTOR A2A)		 6f1s CGLIIR PROTEIN
(Corynebacterium
glutamicum) 		4 / 6 ASN A 598
THR A 608
ILE A 594
GLU A 595
 None
None
None
FMT  A 701 ( 3.9A)
 1.32A 5uigA-6f1sA:
undetectable		 5uigA-6f1sA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UXC_A_ZITA306_1
(PREDICTED
AMINOGLYCOSIDE
PHOSPHOTRANSFERASE)		 3ll7 PUTATIVE
METHYLTRANSFERASE
(Porphyromonas
gingivalis) 		4 / 7 THR A 392
PHE A 345
LEU A 369
SER A 378
 FMT  A 510 ( 3.9A)
None
None
None
 1.30A 5uxcA-3ll7A:
undetectable		 5uxcA-3ll7A:
21.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5V02_R_657R201_0
(CALMODULIN-1
SMALL CONDUCTANCE
CALCIUM-ACTIVATED
POTASSIUM CHANNEL
PROTEIN 2)		 4dgf SULFATE TRANSPORTER
SULFATE TRANSPORTER
FAMILY PROTEIN
(Wolinella
succinogenes) 		5 / 10 ALA A 502
LEU A 503
LEU A 487
VAL A 467
ILE A 459
 None
None
None
FMT  A 602 ( 4.1A)
FMT  A 602 (-4.7A)
 0.93A 5v02B-4dgfA:
undetectable
5v02R-4dgfA:
undetectable		 5v02B-4dgfA:
20.29
5v02R-4dgfA:
22.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VKQ_A_PCFA1805_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)		 3lcr TAUTOMYCETIN
BIOSYNTHETIC PKS
(Streptomyces
sp.
CK4412) 		4 / 7 VAL A  67
HIS A 131
ILE A 259
THR A  69
 FMT  A3613 (-4.6A)
None
None
DMS  A3092 (-3.8A)
 1.06A 5vkqA-3lcrA:
undetectable
5vkqD-3lcrA:
undetectable		 5vkqA-3lcrA:
11.03
5vkqD-3lcrA:
11.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VNC_C_GCSC801_1
(GLYCOGEN [STARCH]
SYNTHASE ISOFORM 2)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		6 / 10 GLY A 114
HIS A 334
VAL A 408
ASN A 437
LYS A 528
GLU A 626
 PO4  A1794 (-3.4A)
FMT  A1799 (-3.9A)
None
FMT  A1799 (-3.5A)
PO4  A1794 ( 3.9A)
None
 0.91A 5vncC-2c4mA:
17.1		 5vncC-2c4mA:
6.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VNC_C_GCSC801_1
(GLYCOGEN [STARCH]
SYNTHASE ISOFORM 2)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		6 / 10 GLY A 114
HIS A 334
VAL A 408
ASN A 437
LYS A 528
GLY A 629
 PO4  A1794 (-3.4A)
FMT  A1799 (-3.9A)
None
FMT  A1799 (-3.5A)
PO4  A1794 ( 3.9A)
PLP  A1634 ( 3.8A)
 0.78A 5vncC-2c4mA:
17.1		 5vncC-2c4mA:
6.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5WYQ_B_SAMB301_0
(TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE)		 3s9j MEMBER OF DUF4221
FAMILY
(Bacteroides
vulgatus) 		6 / 12 TYR A 217
GLY A 274
ILE A 176
TYR A 209
GLY A 223
GLY A 222
 None
None
None
None
FMT  A 404 ( 3.2A)
GOL  A 416 ( 3.3A)
 1.14A 5wyqB-3s9jA:
undetectable		 5wyqB-3s9jA:
20.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5X19_C_CHDC304_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 4az1 TYROSINE SPECIFIC
PROTEIN PHOSPHATASE
(Trypanosoma
cruzi) 		4 / 5 LEU A 176
PHE A 186
LEU A 108
PHE A 104
 None
None
None
FMT  A1306 ( 4.8A)
 1.03A 5x19C-4az1A:
undetectable
5x19J-4az1A:
undetectable		 5x19C-4az1A:
19.87
5x19J-4az1A:
11.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5X6Y_A_SAMA902_0
(MRNA CAPPING ENZYME
P5)		 4j6c CYTOCHROME P450
MONOOXYGENASE
(Nocardia
farcinica) 		5 / 12 LEU A  26
ALA A 322
GLU A 247
THR A 397
VAL A 395
 None
None
None
FMT  A 504 (-3.0A)
FMT  A 504 (-3.8A)
 1.20A 5x6yA-4j6cA:
undetectable		 5x6yA-4j6cA:
19.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Y2T_A_8LXA501_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 4uug AMINE TRANSAMINASE
(Aspergillus
fumigatus) 		3 / 3 SER A  62
HIS A 309
TYR A 305
 FMT  A 403 (-2.5A)
FMT  A 403 (-3.8A)
FMT  A 403 (-4.3A)
 0.85A 5y2tA-4uugA:
undetectable		 5y2tA-4uugA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Y7P_B_CHDB401_0
(BILE SALT HYDROLASE)		 3nnm CURA
(Lyngbya
majuscula) 		5 / 10 ILE A  80
PHE A  25
LEU A 102
ALA A 243
LEU A 137
 None
None
None
FMT  A 500 (-3.6A)
None
 0.96A 5y7pB-3nnmA:
undetectable		 5y7pB-3nnmA:
20.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Y7P_D_CHDD401_0
(BILE SALT HYDROLASE)		 3nnm CURA
(Lyngbya
majuscula) 		5 / 10 ILE A  80
PHE A  25
LEU A 102
ALA A 243
LEU A 137
 None
None
None
FMT  A 500 (-3.6A)
None
 1.00A 5y7pD-3nnmA:
undetectable		 5y7pD-3nnmA:
20.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Y7P_H_CHDH401_0
(BILE SALT HYDROLASE)		 3nnm CURA
(Lyngbya
majuscula) 		5 / 10 ILE A  80
PHE A  25
LEU A 102
ALA A 243
LEU A 137
 None
None
None
FMT  A 500 (-3.6A)
None
 0.99A 5y7pH-3nnmA:
undetectable		 5y7pH-3nnmA:
20.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5YCN_A_8LXA501_0
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 5u4h UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE
(Acinetobacter
baumannii) 		5 / 12 ARG A  17
GLY A  20
LEU A  29
VAL A  71
LEU A 371
 None
None
None
None
FMT  A 507 ( 4.9A)
 0.89A 5ycnA-5u4hA:
undetectable		 5ycnA-5u4hA:
22.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5YF9_B_NIOB401_1
(CASEIN KINASE II
SUBUNIT ALPHA')		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		4 / 7 VAL A  35
LYS A  52
PHE A  97
ASP A 173
 6A7  A 401 ( 4.5A)
6A7  A 401 ( 2.9A)
6A7  A 401 (-3.8A)
FMT  A 403 ( 3.3A)
 0.80A 5yf9B-5idnA:
17.4		 5yf9B-5idnA:
12.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5YF9_X_NIOX401_1
(CASEIN KINASE II
SUBUNIT ALPHA')		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		5 / 9 VAL A  35
LYS A  52
ILE A  79
PHE A  97
ASP A 173
 6A7  A 401 ( 4.5A)
6A7  A 401 ( 2.9A)
6A7  A 401 (-4.2A)
6A7  A 401 (-3.8A)
FMT  A 403 ( 3.3A)
 0.77A 5yf9X-5idnA:
13.5		 5yf9X-5idnA:
12.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5YN6_A_SAMA401_0
(NSP16 PROTEIN)		 3vpi TYPE VI SECRETION
EXPORTED 1
(Pseudomonas
aeruginosa) 		5 / 12 GLY A  90
GLY A  48
LEU A  84
ASN A 139
ASP A 134
 None
None
None
FMT  A 206 (-3.6A)
None
 1.16A 5yn6A-3vpiA:
undetectable		 5yn6A-3vpiA:
20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5YNI_A_SAMA401_0
(NSP16 PROTEIN)		 3vpi TYPE VI SECRETION
EXPORTED 1
(Pseudomonas
aeruginosa) 		5 / 12 GLY A  90
GLY A  48
LEU A  84
ASN A 139
ASP A 134
 None
None
None
FMT  A 206 (-3.6A)
None
 1.12A 5yniA-3vpiA:
undetectable		 5yniA-3vpiA:
20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5YNM_A_SAMA401_0
(NSP16 PROTEIN)		 3vpi TYPE VI SECRETION
EXPORTED 1
(Pseudomonas
aeruginosa) 		5 / 12 GLY A  90
GLY A  48
LEU A  84
ASN A 139
ASP A 134
 None
None
None
FMT  A 206 (-3.6A)
None
 1.14A 5ynmA-3vpiA:
undetectable		 5ynmA-3vpiA:
20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5YOD_H_BEZH201_0
(NS3 PROTEASE)		 4rmf ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycolicibacteriu
m
smegmatis) 		4 / 5 HIS A 449
SER A 487
TYR A 474
GLY A 486
 FMT  A 702 (-4.3A)
FMT  A 702 ( 4.6A)
None
FMT  A 702 (-3.2A)
 1.00A 5yodH-4rmfA:
undetectable		 5yodH-4rmfA:
16.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5YWM_X_NIOX403_0
(CASEIN KINASE II
SUBUNIT ALPHA')		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		4 / 7 LYS A  52
ILE A  79
PHE A  97
ASP A 173
 6A7  A 401 ( 2.9A)
6A7  A 401 (-4.2A)
6A7  A 401 (-3.8A)
FMT  A 403 ( 3.3A)
 0.59A 5ywmX-5idnA:
16.1		 5ywmX-5idnA:
12.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Z0F_B_DAHB98_0
(MELC
TYROSINASE)		 3c9f 5'-NUCLEOTIDASE
(Candida
albicans) 		5 / 11 HIS A 217
HIS A 249
HIS A 251
HIS A 115
PRO A 409
 ZN  A 601 (-3.5A)
ZN  A 601 ( 3.4A)
None
FMT  A 607 (-4.0A)
None
 1.48A 5z0fA-3c9fA:
undetectable
5z0fB-3c9fA:
undetectable		 5z0fA-3c9fA:
10.22
5z0fB-3c9fA:
7.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Z3J_A_NCAA302_0
(ABRIN A-CHAIN)		 1r4p SHIGA-LIKE TOXIN
TYPE II A SUBUNIT
(Escherichia
coli) 		5 / 6 TYR A  77
VAL A  78
TYR A 114
GLU A 167
ARG A 170
 FMT  A3015 (-4.7A)
FMT  A3015 (-3.7A)
FMT  A3015 ( 4.1A)
None
None
 0.69A 5z3jA-1r4pA:
24.3		 5z3jA-1r4pA:
22.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZHM_B_SAMB301_0
(TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE)		 4mzy NICOTINATE
PHOSPHORIBOSYLTRANSF
ERASE
(Enterococcus
faecalis) 		4 / 4 ARG A 164
SER A 292
ASP A 264
HIS A 205
 CL  A 518 (-3.9A)
None
FMT  A 520 ( 4.5A)
MLA  A 515 (-3.9A)
 1.27A 5zhmA-4mzyA:
0.3		 5zhmA-4mzyA:
18.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZV2_B_LEVB801_2
(FIBROBLAST GROWTH
FACTOR RECEPTOR 1)		 5idn CYCLIN-DEPENDENT
KINASE 8
(Homo
sapiens) 		3 / 3 TYR A  99
LEU A 158
ASP A 173
 6A7  A 401 (-4.9A)
6A7  A 401 (-4.8A)
FMT  A 403 ( 3.3A)
 0.80A 5zv2B-5idnA:
21.5		 5zv2B-5idnA:
13.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZVG_B_SAMB401_0
(389AA LONG
HYPOTHETICAL
NUCLEOLAR PROTEIN)		 5x8j THYMIDYLATE KINASE
(Thermus
thermophilus) 		5 / 12 ALA A  24
PRO A  33
GLY A  31
ASP A  90
ALA A  20
 None
None
None
FMT  A 201 ( 4.6A)
None
 1.03A 5zvgB-5x8jA:
undetectable		 5zvgB-5x8jA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZWR_A_9KLA402_0
(EST-Y29)		 1zv9 CELLULOSOMAL
SCAFFOLDIN ADAPTOR
PROTEIN B
(Acetivibrio
cellulolyticus) 		5 / 12 PHE A 118
ILE A 128
TYR A  58
LEU A  11
GLY A  65
 None
None
None
None
FMT  A4001 (-3.6A)
 1.17A 5zwrA-1zv9A:
undetectable		 5zwrA-1zv9A:
18.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6A5Z_L_9CRL501_0
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 3lp6 PHOSPHORIBOSYLAMINOI
MIDAZOLE CARBOXYLASE
CATALYTIC SUBUNIT
(Mycobacterium
tuberculosis) 		6 / 12 ILE A  66
ALA A  58
ALA A  55
LEU A  63
ALA A  59
LEU A  76
 None
None
None
None
None
FMT  A 177 ( 4.2A)
 1.46A 6a5zL-3lp6A:
undetectable		 6a5zL-3lp6A:
19.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6AY4_A_TPFA506_1
(CYP51, STEROL
14ALPHA-DEMETHYLASE)		 1r4p SHIGA-LIKE TOXIN
TYPE II A SUBUNIT
(Escherichia
coli) 		5 / 10 TYR A  90
MET A 108
ALA A  79
PHE A  92
LEU A 142
 None
None
None
FMT  A3015 ( 4.9A)
None
 1.35A 6ay4A-1r4pA:
undetectable		 6ay4A-1r4pA:
19.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6B5Y_B_9F2B400_1
(BETA-LACTAMASE)		 1k38 BETA-LACTAMASE OXA-2
(Salmonella
enterica) 		6 / 12 SER A  67
SER A 115
ARG A 244
LYS A 205
THR A 206
GLY A 207
 KCX  A  70 ( 2.7A)
FMT  A 401 (-2.4A)
FMT  A 401 (-2.6A)
FMT  A 401 ( 3.8A)
FMT  A 401 (-3.7A)
FMT  A 401 (-3.6A)
 0.83A 6b5yB-1k38A:
19.0		 6b5yB-1k38A:
17.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6B5Y_B_9F2B400_1
(BETA-LACTAMASE)		 5kzh BETA-LACTAMASE
(Acinetobacter
baumannii) 		7 / 12 SER A  80
SER A 127
ARG A 260
LYS A 217
GLY A 219
GLY A 221
ASP A 223
 FMT  A 301 (-2.5A)
FMT  A 301 (-3.3A)
None
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
None
 1.19A 6b5yB-5kzhA:
19.6		 6b5yB-5kzhA:
17.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6B68_B_9F2B301_1
(BETA-LACTAMASE)		 5kzh BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 12 SER A  80
SER A 127
LYS A 217
GLY A 219
GLY A 221
ASP A 223
 FMT  A 301 (-2.5A)
FMT  A 301 (-3.3A)
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
None
 1.08A 6b68B-5kzhA:
19.6		 6b68B-5kzhA:
17.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6B68_D_9F2D400_1
(BETA-LACTAMASE)		 5kzh BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 12 SER A  80
SER A 127
ARG A 260
LYS A 217
GLY A 219
ASP A 223
 FMT  A 301 (-2.5A)
FMT  A 301 (-3.3A)
None
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
 0.98A 6b68D-5kzhA:
19.6		 6b68D-5kzhA:
17.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6B68_D_9F2D400_1
(BETA-LACTAMASE)		 5kzh BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 12 SER A  80
SER A 127
ARG A 260
LYS A 217
GLY A 219
GLY A 221
 FMT  A 301 (-2.5A)
FMT  A 301 (-3.3A)
None
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
 0.86A 6b68D-5kzhA:
19.6		 6b68D-5kzhA:
17.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6B69_B_9F2B301_1
(BETA-LACTAMASE)		 5kzh BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 12 SER A  80
SER A 127
LYS A 217
GLY A 219
GLY A 221
ASP A 223
 FMT  A 301 (-2.5A)
FMT  A 301 (-3.3A)
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
None
 1.06A 6b69A-5kzhA:
19.6
6b69B-5kzhA:
19.5		 6b69A-5kzhA:
17.22
6b69B-5kzhA:
17.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6B69_D_9F2D301_1
(BETA-LACTAMASE)		 1k38 BETA-LACTAMASE OXA-2
(Salmonella
enterica) 		6 / 12 SER A  67
SER A 115
ARG A 244
LYS A 205
THR A 206
GLY A 207
 KCX  A  70 ( 2.7A)
FMT  A 401 (-2.4A)
FMT  A 401 (-2.6A)
FMT  A 401 ( 3.8A)
FMT  A 401 (-3.7A)
FMT  A 401 (-3.6A)
 0.83A 6b69D-1k38A:
18.7		 6b69D-1k38A:
17.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6B6A_B_9F2B301_1
(BETA-LACTAMASE)		 1k38 BETA-LACTAMASE OXA-2
(Salmonella
enterica) 		6 / 12 SER A  67
SER A 115
ARG A 244
LYS A 205
THR A 206
GLY A 207
 KCX  A  70 ( 2.7A)
FMT  A 401 (-2.4A)
FMT  A 401 (-2.6A)
FMT  A 401 ( 3.8A)
FMT  A 401 (-3.7A)
FMT  A 401 (-3.6A)
 0.80A 6b6aB-1k38A:
18.6		 6b6aB-1k38A:
17.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6B6A_B_9F2B301_1
(BETA-LACTAMASE)		 5kzh BETA-LACTAMASE
(Acinetobacter
baumannii) 		7 / 12 SER A  80
SER A 127
ARG A 260
LYS A 217
GLY A 219
GLY A 221
ASP A 223
 FMT  A 301 (-2.5A)
FMT  A 301 (-3.3A)
None
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
None
 1.14A 6b6aB-5kzhA:
19.7		 6b6aB-5kzhA:
17.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6B6A_D_9F2D301_1
(BETA-LACTAMASE)		 1k38 BETA-LACTAMASE OXA-2
(Salmonella
enterica) 		6 / 12 SER A  67
SER A 115
ARG A 244
LYS A 205
THR A 206
GLY A 207
 KCX  A  70 ( 2.7A)
FMT  A 401 (-2.4A)
FMT  A 401 (-2.6A)
FMT  A 401 ( 3.8A)
FMT  A 401 (-3.7A)
FMT  A 401 (-3.6A)
 0.81A 6b6aD-1k38A:
18.6		 6b6aD-1k38A:
17.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6B6A_D_9F2D301_1
(BETA-LACTAMASE)		 5kzh BETA-LACTAMASE
(Acinetobacter
baumannii) 		7 / 12 SER A  80
SER A 127
ARG A 260
LYS A 217
GLY A 219
GLY A 221
ASP A 223
 FMT  A 301 (-2.5A)
FMT  A 301 (-3.3A)
None
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
None
 1.13A 6b6aD-5kzhA:
19.5		 6b6aD-5kzhA:
17.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6B6C_A_9F2A301_1
(BETA-LACTAMASE)		 1k38 BETA-LACTAMASE OXA-2
(Salmonella
enterica) 		6 / 12 SER A  67
SER A 115
ARG A 244
LYS A 205
THR A 206
GLY A 207
 KCX  A  70 ( 2.7A)
FMT  A 401 (-2.4A)
FMT  A 401 (-2.6A)
FMT  A 401 ( 3.8A)
FMT  A 401 (-3.7A)
FMT  A 401 (-3.6A)
 0.88A 6b6cA-1k38A:
18.9		 6b6cA-1k38A:
17.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6B6C_A_9F2A301_1
(BETA-LACTAMASE)		 5kzh BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 12 ILE A 129
SER A 127
ARG A 260
LYS A 217
GLY A 219
GLY A 221
 KCX  A  83 ( 4.2A)
FMT  A 301 (-3.3A)
None
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
 1.37A 6b6cA-5kzhA:
19.6		 6b6cA-5kzhA:
17.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6B6C_A_9F2A301_1
(BETA-LACTAMASE)		 5kzh BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 12 SER A  80
SER A 127
ARG A 260
LYS A 217
GLY A 219
GLY A 221
 FMT  A 301 (-2.5A)
FMT  A 301 (-3.3A)
None
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
 0.88A 6b6cA-5kzhA:
19.6		 6b6cA-5kzhA:
17.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6B6E_A_9F2A302_1
(BETA-LACTAMASE)		 1k38 BETA-LACTAMASE OXA-2
(Salmonella
enterica) 		6 / 12 SER A  67
SER A 115
ARG A 244
LYS A 205
THR A 206
GLY A 207
 KCX  A  70 ( 2.7A)
FMT  A 401 (-2.4A)
FMT  A 401 (-2.6A)
FMT  A 401 ( 3.8A)
FMT  A 401 (-3.7A)
FMT  A 401 (-3.6A)
 0.82A 6b6eA-1k38A:
18.9		 6b6eA-1k38A:
17.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6B6E_A_9F2A302_1
(BETA-LACTAMASE)		 5kzh BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 12 ILE A 129
SER A 127
ARG A 260
LYS A 217
GLY A 219
GLY A 221
 KCX  A  83 ( 4.2A)
FMT  A 301 (-3.3A)
None
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
 1.41A 6b6eA-5kzhA:
19.6		 6b6eA-5kzhA:
17.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6B6E_A_9F2A302_1
(BETA-LACTAMASE)		 5kzh BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 12 SER A  80
SER A 127
ARG A 260
LYS A 217
GLY A 219
GLY A 221
 FMT  A 301 (-2.5A)
FMT  A 301 (-3.3A)
None
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
 0.87A 6b6eA-5kzhA:
19.6		 6b6eA-5kzhA:
17.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6B6F_A_9F2A301_1
(BETA-LACTAMASE)		 5kzh BETA-LACTAMASE
(Acinetobacter
baumannii) 		6 / 12 SER A  80
SER A 127
LYS A 217
GLY A 219
GLY A 221
ASP A 223
 FMT  A 301 (-2.5A)
FMT  A 301 (-3.3A)
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
None
 1.17A 6b6fA-5kzhA:
19.5		 6b6fA-5kzhA:
17.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6B94_A_W9TA201_0
(GALECTIN-1)		 4ihc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Dickeya
paradisiaca) 		4 / 8 ASN A 338
HIS A 298
GLU A 352
ARG A 296
 None
None
FMT  A 503 (-3.2A)
FMT  A 503 (-4.1A)
 1.15A 6b94A-4ihcA:
undetectable		 6b94A-4ihcA:
11.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6BEO_A_DHIA4_0
((DPR)PY(DHI)PKDL(DGN
))		 4ae5 SIGNAL TRANSDUCTION
PROTEIN TRAP
(Staphylococcus
aureus) 		3 / 3 TYR A   8
PRO A  50
LEU A  47
 FMT  A1000 (-4.5A)
None
None
 0.71A 6beoA-4ae5A:
undetectable		 6beoA-4ae5A:
4.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6BM5_A_SAMA1301_0
(METHIONINE SYNTHASE)		 5zwp GLUTATHIONE
S-TRANSFERASE 1
(Musca
domestica) 		5 / 11 ASP A 100
ARG A  66
TYR A 113
PRO A 114
TYR A 112
 None
GSH  A 301 (-3.4A)
FMT  A 302 (-4.4A)
None
None
 1.45A 6bm5A-5zwpA:
undetectable		 6bm5A-5zwpA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6BRD_C_RFPC502_1
(RIFAMPIN
MONOOXYGENASE)		 5umu FACT COMPLEX SUBUNIT
SPT16
(Homo
sapiens) 		5 / 12 VAL A 868
VAL A 860
GLY A 896
ARG A 847
VAL A 848
 None
None
FMT  A1011 ( 4.3A)
None
None
 1.16A 6brdC-5umuA:
undetectable		 6brdC-5umuA:
24.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6BXM_A_SAMA402_0
(DIPHTHAMIDE
BIOSYNTHESIS ENZYME
DPH2)		 4mzy NICOTINATE
PHOSPHORIBOSYLTRANSF
ERASE
(Enterococcus
faecalis) 		5 / 12 LEU A 158
GLY A 314
VAL A 275
ILE A 263
ASP A 264
 None
None
None
None
FMT  A 520 ( 4.5A)
 1.11A 6bxmA-4mzyA:
undetectable		 6bxmA-4mzyA:
23.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6C2M_C_SUEC1203_0
(NS3 PROTEASE)		 3cp7 ALKALINE SERINE
PROTEASE AL20
(Nesterenkonia
aethiopica) 		5 / 12 HIS A  41
ASP A  91
GLY A 167
SER A 169
VAL A 197
 FMT  A 219 (-3.9A)
None
FMT  A 219 (-3.6A)
FMT  A 219 (-2.6A)
None
 1.05A 6c2mC-3cp7A:
6.1		 6c2mC-3cp7A:
19.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6CGD_A_AKNA600_1
(BIFUNCTIONAL AAC/APH)		 3gip N-ACYL-D-GLUTAMATE
DEACYLASE
(Bordetella
bronchiseptica) 		5 / 10 GLY A 187
TYR A 190
ASP A 365
TYR A 282
TYR A 343
 None
ACY  A 481 (-4.6A)
ACY  A 481 ( 2.5A)
FMT  A 482 (-4.4A)
FMT  A 483 (-4.4A)
 1.44A 6cgdA-3gipA:
undetectable		 6cgdA-3gipA:
9.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6CLX_B_SAMB401_0
(O-METHYLTRANSFERASE)		 3slz GAG-PRO-POL
POLYPROTEIN
(Murine
leukemia
virus) 		5 / 10 GLY A  94
ASP A  96
SER A  81
PHE A  82
VAL A  31
 None
None
FMT  A 128 ( 3.0A)
None
None
 1.45A 6clxB-3slzA:
undetectable		 6clxB-3slzA:
18.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6DYN_A_HSMA901_0
(EBONY)		 4bx9 VACUOLAR PROTEIN
SORTING-ASSOCIATED
PROTEIN 33A
(Homo
sapiens) 		4 / 4 GLU A  22
VAL A  19
LEU A  15
THR A 181
 None
None
None
FMT  A1596 ( 4.0A)
 1.37A 6dynA-4bx9A:
undetectable		 6dynA-4bx9A:
10.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6DYO_A_LDPA901_0
(EBONY)		 4bx9 VACUOLAR PROTEIN
SORTING-ASSOCIATED
PROTEIN 33A
(Homo
sapiens) 		4 / 5 GLU A  22
VAL A  19
LEU A  15
THR A 181
 None
None
None
FMT  A1596 ( 4.0A)
 1.38A 6dyoA-4bx9A:
undetectable		 6dyoA-4bx9A:
10.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6E43_A_BEZA502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 3ll7 PUTATIVE
METHYLTRANSFERASE
(Porphyromonas
gingivalis) 		4 / 6 VAL A 399
LEU A 322
LEU A 316
HIS A 317
 None
None
None
FMT  A 510 (-4.1A)
 1.02A 6e43A-3ll7A:
undetectable		 6e43A-3ll7A:
23.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6E43_B_BEZB502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 3ll7 PUTATIVE
METHYLTRANSFERASE
(Porphyromonas
gingivalis) 		4 / 6 VAL A 399
LEU A 322
LEU A 316
HIS A 317
 None
None
None
FMT  A 510 (-4.1A)
 1.03A 6e43B-3ll7A:
undetectable		 6e43B-3ll7A:
23.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6E43_C_BEZC502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 3ll7 PUTATIVE
METHYLTRANSFERASE
(Porphyromonas
gingivalis) 		4 / 6 VAL A 399
LEU A 322
LEU A 316
HIS A 317
 None
None
None
FMT  A 510 (-4.1A)
 1.01A 6e43C-3ll7A:
undetectable		 6e43C-3ll7A:
23.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6EXI_A_ADNA503_1
(ADENOSYLHOMOCYSTEINA
SE)		 1vp4 AMINOTRANSFERASE,
PUTATIVE
(Thermotoga
maritima) 		3 / 3 LEU A  83
GLN A  80
LYS A 263
 EDO  A 603 ( 4.1A)
None
FMT  A 614 ( 4.6A)
 0.99A 6exiB-1vp4A:
2.2		 6exiB-1vp4A:
15.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6EXI_A_ADNA503_1
(ADENOSYLHOMOCYSTEINA
SE)		 2poe CYCLOPHILIN-LIKE
PROTEIN, PUTATIVE
(Cryptosporidium
parvum) 		3 / 3 LEU A 131
GLN A 130
LYS A 108
 None
None
FMT  A 203 ( 4.8A)
 0.92A 6exiB-2poeA:
undetectable		 6exiB-2poeA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6EXI_B_ADNB503_0
(ADENOSYLHOMOCYSTEINA
SE)		 2poe CYCLOPHILIN-LIKE
PROTEIN, PUTATIVE
(Cryptosporidium
parvum) 		3 / 3 LEU A 131
GLN A 130
LYS A 108
 None
None
FMT  A 203 ( 4.8A)
 0.93A 6exiA-2poeA:
undetectable		 6exiA-2poeA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F8C_A_STRA502_1
(CYTOCHROME P450
CYP260A1)		 1vp4 AMINOTRANSFERASE,
PUTATIVE
(Thermotoga
maritima) 		5 / 6 ALA A 134
GLY A 105
THR A 103
ILE A 269
PHE A 265
 None
PLP  A 501 (-3.2A)
None
None
FMT  A 622 ( 4.4A)
 1.06A 6f8cA-1vp4A:
undetectable		 6f8cA-1vp4A:
11.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F8C_A_STRA502_1
(CYTOCHROME P450
CYP260A1)		 1vp4 AMINOTRANSFERASE,
PUTATIVE
(Thermotoga
maritima) 		5 / 6 ALA A 137
GLY A 105
THR A 103
ILE A 269
PHE A 265
 None
PLP  A 501 (-3.2A)
None
None
FMT  A 622 ( 4.4A)
 1.21A 6f8cA-1vp4A:
undetectable		 6f8cA-1vp4A:
11.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6FBN_B_SAMB401_1
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 2qfq 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Escherichia
coli) 		4 / 8 HIS A 385
LYS A 411
SER A  25
ASP A 313
 FMT  A 601 (-4.3A)
FMT  A 602 (-2.8A)
None
S3P  A 701 ( 2.8A)
 1.07A 6fbnB-2qfqA:
undetectable		 6fbnB-2qfqA:
23.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6FBO_A_ADNA406_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 2qfq 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Escherichia
coli) 		4 / 8 HIS A 385
LYS A 411
SER A  25
ASP A 313
 FMT  A 601 (-4.3A)
FMT  A 602 (-2.8A)
None
S3P  A 701 ( 2.8A)
 1.14A 6fboA-2qfqA:
undetectable		 6fboA-2qfqA:
10.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6FCB_A_SAMA405_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 2qfq 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Escherichia
coli) 		4 / 8 HIS A 385
LYS A 411
SER A  25
ASP A 313
 FMT  A 601 (-4.3A)
FMT  A 602 (-2.8A)
None
S3P  A 701 ( 2.8A)
 1.09A 6fcbA-2qfqA:
undetectable		 6fcbA-2qfqA:
23.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6FCD_A_ADNA405_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 2qfq 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Escherichia
coli) 		4 / 8 HIS A 385
LYS A 411
SER A  25
ASP A 313
 FMT  A 601 (-4.3A)
FMT  A 602 (-2.8A)
None
S3P  A 701 ( 2.8A)
 1.15A 6fcdA-2qfqA:
undetectable		 6fcdA-2qfqA:
10.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6FN9_A_BEZA302_0
(14-3-3 PROTEIN
ZETA/DELTA)		 5umu FACT COMPLEX SUBUNIT
SPT16
(Homo
sapiens) 		3 / 3 MET A 676
GLN A 677
ARG A 675
 None
None
FMT  A1009 ( 4.6A)
 1.12A 6fn9A-5umuA:
undetectable		 6fn9A-5umuA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6FNA_B_BEZB302_0
(14-3-3 PROTEIN
ZETA/DELTA)		 5umu FACT COMPLEX SUBUNIT
SPT16
(Homo
sapiens) 		3 / 3 MET A 676
GLN A 677
ARG A 675
 None
None
FMT  A1009 ( 4.6A)
 1.13A 6fnaB-5umuA:
undetectable		 6fnaB-5umuA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6FNB_A_BEZA301_0
(14-3-3 PROTEIN
ZETA/DELTA)		 5umu FACT COMPLEX SUBUNIT
SPT16
(Homo
sapiens) 		3 / 3 MET A 676
GLN A 677
ARG A 675
 None
None
FMT  A1009 ( 4.6A)
 1.10A 6fnbA-5umuA:
undetectable		 6fnbA-5umuA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6FOS_A_PQNA2001_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1)		 2qfq 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Escherichia
coli) 		4 / 6 MET A  53
GLY A  96
ALA A 103
LEU A 115
 None
FMT  A 602 (-3.4A)
None
None
 1.08A 6fosA-2qfqA:
undetectable		 6fosA-2qfqA:
10.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6G6R_A_SAMA406_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 2qfq 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Escherichia
coli) 		4 / 7 HIS A 385
LYS A 411
SER A  25
ASP A 313
 FMT  A 601 (-4.3A)
FMT  A 602 (-2.8A)
None
S3P  A 701 ( 2.8A)
 1.14A 6g6rA-2qfqA:
undetectable		 6g6rA-2qfqA:
23.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GNE_A_ACRA602_1
(-)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		5 / 12 GLY A 113
GLY A 114
ASP A 296
VAL A 408
ASN A 437
 PO4  A1794 (-3.5A)
PO4  A1794 (-3.4A)
None
None
FMT  A1799 (-3.5A)
 0.85A 6gneA-2c4mA:
23.3		 6gneA-2c4mA:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GNE_A_ACRA602_1
(-)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		5 / 12 GLY A 113
GLY A 114
VAL A 408
ASN A 437
GLY A 629
 PO4  A1794 (-3.5A)
PO4  A1794 (-3.4A)
None
FMT  A1799 (-3.5A)
PLP  A1634 ( 3.8A)
 0.83A 6gneA-2c4mA:
23.3		 6gneA-2c4mA:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GNE_B_ACRB602_1
(-)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		6 / 12 GLU A  67
GLY A 113
GLY A 114
ASP A 296
VAL A 408
ASN A 437
 None
PO4  A1794 (-3.5A)
PO4  A1794 (-3.4A)
None
None
FMT  A1799 (-3.5A)
 0.81A 6gneB-2c4mA:
23.1		 6gneB-2c4mA:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GNE_B_ACRB602_1
(-)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		6 / 12 GLU A  67
GLY A 113
GLY A 114
VAL A 408
ASN A 437
GLY A 629
 None
PO4  A1794 (-3.5A)
PO4  A1794 (-3.4A)
None
FMT  A1799 (-3.5A)
PLP  A1634 ( 3.8A)
 0.78A 6gneB-2c4mA:
23.1		 6gneB-2c4mA:
20.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GNF_A_QPSA602_1
(-)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		5 / 12 ASP A 248
ASP A 296
HIS A 298
ASN A 437
GLU A 626
 None
None
None
FMT  A1799 (-3.5A)
None
 1.01A 6gnfA-2c4mA:
23.0		 6gnfA-2c4mA:
21.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GNF_A_QPSA602_2
(-)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		5 / 9 GLY A 113
GLY A 114
TYR A 245
HIS A 334
VAL A 408
 PO4  A1794 (-3.5A)
PO4  A1794 (-3.4A)
None
FMT  A1799 (-3.9A)
None
 0.92A 6gnfA-2c4mA:
23.0		 6gnfA-2c4mA:
21.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GNF_C_QPSC602_1
(-)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		5 / 10 GLY A 114
LEU A 115
TYR A 245
HIS A 334
VAL A 408
 PO4  A1794 (-3.4A)
None
None
FMT  A1799 (-3.9A)
None
 0.90A 6gnfC-2c4mA:
22.7		 6gnfC-2c4mA:
21.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GNF_C_QPSC602_2
(-)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		5 / 12 ASP A 248
ASP A 296
HIS A 298
ASN A 437
GLU A 626
 None
None
None
FMT  A1799 (-3.5A)
None
 1.02A 6gnfC-2c4mA:
22.8		 6gnfC-2c4mA:
21.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GNG_A_QPSA601_1
(-)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		5 / 12 GLY A 113
LEU A 115
ASP A 248
ASP A 296
ASN A 437
 PO4  A1794 (-3.5A)
None
None
None
FMT  A1799 (-3.5A)
 1.01A 6gngA-2c4mA:
22.4		 6gngA-2c4mA:
23.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GNG_A_QPSA601_1
(-)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		5 / 12 GLY A 113
LEU A 115
ASP A 296
HIS A 298
ASN A 437
 PO4  A1794 (-3.5A)
None
None
None
FMT  A1799 (-3.5A)
 0.80A 6gngA-2c4mA:
22.4		 6gngA-2c4mA:
23.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GNG_A_QPSA601_2
(-)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		5 / 12 GLU A  67
GLY A 114
TYR A 245
HIS A 334
GLU A 626
 None
PO4  A1794 (-3.4A)
None
FMT  A1799 (-3.9A)
None
 0.82A 6gngA-2c4mA:
22.4		 6gngA-2c4mA:
23.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GNG_A_QPSA601_2
(-)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		6 / 12 GLU A  67
GLY A 114
TYR A 245
HIS A 334
VAL A 408
GLY A 629
 None
PO4  A1794 (-3.4A)
None
FMT  A1799 (-3.9A)
None
PLP  A1634 ( 3.8A)
 0.87A 6gngA-2c4mA:
22.4		 6gngA-2c4mA:
23.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GNG_B_QPSB601_3
(-)		 2c4m GLYCOGEN
PHOSPHORYLASE
(Corynebacterium
callunae) 		3 / 3 ASP A 248
ASP A 296
ASN A 437
 None
None
FMT  A1799 (-3.5A)
 0.81A 6gngB-2c4mA:
22.4		 6gngB-2c4mA:
23.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GP2_A_DAHA126_0
(RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
BETA CHAIN)		 4q9d BENZOYLFORMATE
DECARBOXYLASE
(Mycolicibacteriu
m
smegmatis) 		5 / 11 LEU A 385
THR A 381
GLY A 433
ILE A 432
PHE A 397
 None
None
FMT  A 603 (-3.3A)
None
None
 0.95A 6gp2A-4q9dA:
undetectable		 6gp2A-4q9dA:
8.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GP2_B_DAHB126_0
(RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
BETA CHAIN)		 4q9d BENZOYLFORMATE
DECARBOXYLASE
(Mycolicibacteriu
m
smegmatis) 		5 / 11 LEU A 385
THR A 381
GLY A 433
ILE A 432
PHE A 397
 None
None
FMT  A 603 (-3.3A)
None
None
 0.92A 6gp2B-4q9dA:
undetectable		 6gp2B-4q9dA:
8.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GTQ_A_ACTA204_0
(N-ACETYLTRANSFERASE)		 5txr 5-AMINOLEVULINATE
SYNTHASE,
MITOCHONDRIAL
(Saccharomyces
cerevisiae) 		4 / 5 LEU B 472
THR B 469
THR B 465
GLY B 467
 None
None
None
FMT  B 603 ( 3.9A)
 0.95A 6gtqA-5txrB:
undetectable		 6gtqA-5txrB:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6H1L_A_FJQA501_0
(BIFUNCTIONAL
CYTOCHROME
P450/NADPH--P450
REDUCTASE)		 6c5b METHYLTRANSFERASE
(Lysobacter
antibioticus) 		5 / 10 LEU A 193
PHE A 172
VAL A 178
ALA A 183
LEU A 188
 None
None
None
FMT  A 502 ( 3.9A)
FMT  A 502 (-4.4A)
 0.97A 6h1lA-6c5bA:
undetectable		 6h1lA-6c5bA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6HU9_N_PCFN606_0
(CYTOCHROME B)		 3o5a PERIPLASMIC NITRATE
REDUCTASE
(Cupriavidus
necator) 		5 / 12 ALA A  17
TYR A 509
VAL A 503
VAL A 523
TYR A 587
 None
None
None
None
FMT  A 805 (-4.8A)
 1.34A 6hu9N-3o5aA:
undetectable		 6hu9N-3o5aA:
19.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6N91_A_DCFA401_1
(ADENOSINE DEAMINASE)		 4pys BETA-N-ACETYLHEXOSAM
INIDASE
(Bacteroides
fragilis) 		4 / 4 HIS A 299
LEU A 364
TYR A 391
GLY A 354
 None
None
None
FMT  A 607 (-3.0A)
 1.04A 6n91A-4pysA:
4.6		 6n91A-4pysA:
10.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6N91_B_DCFB401_1
(ADENOSINE DEAMINASE)		 4pys BETA-N-ACETYLHEXOSAM
INIDASE
(Bacteroides
fragilis) 		4 / 4 HIS A 299
LEU A 364
TYR A 391
GLY A 354
 None
None
None
FMT  A 607 (-3.0A)
 1.05A 6n91B-4pysA:
4.7		 6n91B-4pysA:
10.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6NJ9_K_SAMK500_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-79
SPECIFIC)		 6c5b METHYLTRANSFERASE
(Lysobacter
antibioticus) 		5 / 12 ASP A 180
GLY A 182
GLY A 184
ASP A 232
PHE A 233
 FMT  A 502 (-2.6A)
SAH  A 501 (-4.0A)
SAH  A 501 (-3.3A)
SAH  A 501 (-3.5A)
SAH  A 501 (-3.5A)
 0.79A 6nj9K-6c5bA:
8.5		 6nj9K-6c5bA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6NKN_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 4hnh NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E
(Veillonella
parvula) 		3 / 3 ARG A  99
PHE A 187
PHE A 198
 None
FMT  A 307 ( 3.9A)
None
 0.92A 6nknC-4hnhA:
undetectable
6nknJ-4hnhA:
undetectable		 6nknC-4hnhA:
20.69
6nknJ-4hnhA:
14.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6NKN_W_CHDW101_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 4low ACRAF
(Thiomonas
intermedia) 		3 / 3 ARG A  76
LEU A  19
PHE A  20
 FMT  A 104 (-3.8A)
None
FMT  A 105 (-4.5A)
 0.75A 6nknP-4lowA:
undetectable		 6nknP-4lowA:
18.08