SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3mpg'

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.
1A7Y_A_DVAA8_0
(ACTINOMYCIN D)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		3 / 3 THR A 390
THR A 391
PRO A 389
 None
 0.85A 1a7yA-3mpgA:
undetectable		 1a7yA-3mpgA:
2.20
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.
1E9Y_B_HAEB800_1
(UREASE SUBUNIT BETA)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 5 HIS A  59
HIS A 178
HIS A 231
ASP A 304
 ZN  A 429 (-3.4A)
ZN  A 430 (-3.3A)
ZN  A 430 (-3.6A)
ZN  A 429 (-2.9A)
 0.59A 1e9yB-3mpgA:
20.4		 1e9yB-3mpgA:
21.37
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.
1EI6_A_PPFA410_1
(PHOSPHONOACETATE
HYDROLASE)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 5 ASP A 151
HIS A 178
HIS A  59
HIS A 231
 ZN  A 429 ( 2.7A)
ZN  A 430 (-3.3A)
ZN  A 429 (-3.4A)
ZN  A 430 (-3.6A)
 1.19A 1ei6A-3mpgA:
undetectable		 1ei6A-3mpgA:
24.54
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.
1F86_A_T44A428_1
(TRANSTHYRETIN
THR119MET VARIANT)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 4 LYS A 166
LEU A 162
ALA A 223
LEU A 219
 None
 1.43A 1f86A-3mpgA:
undetectable		 1f86A-3mpgA:
13.98
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.
1F86_B_T44B528_1
(TRANSTHYRETIN
THR119MET VARIANT)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 4 LYS A 166
LEU A 162
ALA A 223
LEU A 219
 None
 1.16A 1f86B-3mpgA:
undetectable		 1f86B-3mpgA:
13.98
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.
1FOH_A_IPHA802_0
(PHENOL HYDROXYLASE)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 10 ASP A 150
GLY A 154
MET A 161
VAL A 155
ILE A 125
 None
 1.38A 1fohA-3mpgA:
undetectable		 1fohA-3mpgA:
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.
1FOH_D_IPHD802_0
(PHENOL HYDROXYLASE)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 10 ASP A 150
GLY A 154
MET A 161
VAL A 155
ILE A 125
 None
 1.41A 1fohD-3mpgA:
undetectable		 1fohD-3mpgA:
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.
1FWE_C_HAEC989_1
(UREASE)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 6 HIS A  59
HIS A  61
HIS A 178
HIS A 231
ASP A 304
 ZN  A 429 (-3.4A)
ZN  A 429 (-3.6A)
ZN  A 430 (-3.3A)
ZN  A 430 (-3.6A)
ZN  A 429 (-2.9A)
 0.56A 1fweC-3mpgA:
21.5		 1fweC-3mpgA:
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.
1I3W_F_DVAF8_0
(ACTINOMYCIN D)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		3 / 3 THR A 390
THR A 391
PRO A 389
 None
 0.83A 1i3wF-3mpgA:
undetectable		 1i3wF-3mpgA:
2.20
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.
1JB0_A_PQNA2001_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 9 PHE A 327
SER A 394
GLY A 396
ALA A 306
GLY A 326
 None
 1.12A 1jb0A-3mpgA:
undetectable		 1jb0A-3mpgA:
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.
1MNV_D_DVAD2_0
(ACTINOMYCIN D)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		3 / 3 THR A 391
PRO A 389
THR A 390
 None
 0.84A 1mnvD-3mpgA:
undetectable		 1mnvD-3mpgA:
2.20
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.
1MNV_D_DVAD8_0
(ACTINOMYCIN D)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		3 / 3 THR A 390
THR A 391
PRO A 389
 None
 0.80A 1mnvD-3mpgA:
undetectable		 1mnvD-3mpgA:
2.20
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.
1OE1_A_CUA502_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		3 / 3 ASP A 304
HIS A 231
HIS A  59
 ZN  A 429 (-2.9A)
ZN  A 430 (-3.6A)
ZN  A 429 (-3.4A)
 0.67A 1oe1A-3mpgA:
undetectable		 1oe1A-3mpgA:
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.
1OE3_A_CUA502_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		3 / 3 ASP A 304
HIS A 231
HIS A  59
 ZN  A 429 (-2.9A)
ZN  A 430 (-3.6A)
ZN  A 429 (-3.4A)
 0.68A 1oe3A-3mpgA:
undetectable		 1oe3A-3mpgA:
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.
1QFI_A_DVAA8_0
(ACTINOMYCIN X2)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		3 / 3 THR A 390
THR A 391
PRO A 389
 None
 0.82A 1qfiA-3mpgA:
undetectable		 1qfiA-3mpgA:
2.20
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.
2FB2_A_SAMA501_0
(MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
A)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 8 TYR A 122
CYH A  89
THR A 360
VAL A 176
 None
 1.00A 2fb2A-3mpgA:
3.8		 2fb2A-3mpgA:
20.45
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.
2P02_A_SAMA2_0
(S-ADENOSYLMETHIONINE
SYNTHETASE ISOFORM
TYPE-2)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 8 ASP A  57
SER A 394
PHE A 327
ASP A 304
 None
None
None
ZN  A 429 (-2.9A)
 1.18A 2p02A-3mpgA:
undetectable		 2p02A-3mpgA:
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.
2XXG_A_CUA1338_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		3 / 3 ASP A 304
HIS A 231
HIS A  59
 ZN  A 429 (-2.9A)
ZN  A 430 (-3.6A)
ZN  A 429 (-3.4A)
 0.69A 2xxgA-3mpgA:
undetectable		 2xxgA-3mpgA:
23.20
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.
2XXG_C_CUC1339_0
(DISSIMILATORY
COPPER-CONTAINING
NITRITE REDUCTASE)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		3 / 3 ASP A 304
HIS A 231
HIS A  59
 ZN  A 429 (-2.9A)
ZN  A 430 (-3.6A)
ZN  A 429 (-3.4A)
 0.69A 2xxgC-3mpgA:
undetectable		 2xxgC-3mpgA:
23.20
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.
3IV6_D_SAMD301_0
(PUTATIVE
ZN-DEPENDENT ALCOHOL
DEHYDROGENASE)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 12 GLY A  76
SER A 394
ILE A  73
LEU A  62
ARG A  63
 None
 1.18A 3iv6D-3mpgA:
undetectable		 3iv6D-3mpgA:
22.35
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.
3P4W_B_DSFB319_1
(GLR4197 PROTEIN)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 9 ILE A 378
ILE A 376
MET A 412
VAL A  46
ILE A  44
 None
 1.21A 3p4wB-3mpgA:
undetectable		 3p4wB-3mpgA:
20.81
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.
3P4W_D_DSFD319_1
(GLR4197 PROTEIN)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 10 ILE A 378
ILE A 376
MET A 412
VAL A  46
ILE A  44
 None
 1.22A 3p4wD-3mpgA:
undetectable		 3p4wD-3mpgA:
20.81
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.
3P4W_E_DSFE319_1
(GLR4197 PROTEIN)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 10 ILE A 378
ILE A 376
MET A 412
VAL A  46
ILE A  44
 None
 1.23A 3p4wE-3mpgA:
undetectable		 3p4wE-3mpgA:
20.81
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.
3PCQ_A_PQNA847_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 9 PHE A 327
SER A 394
GLY A 396
ALA A 306
GLY A 326
 None
 1.12A 3pcqA-3mpgA:
undetectable		 3pcqA-3mpgA:
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.
3TM4_B_SAMB401_1
(TRNA (GUANINE
N2-)-METHYLTRANSFERA
SE TRM14)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 5 HIS A 305
THR A  77
GLU A 328
ASP A 388
 None
 1.32A 3tm4B-3mpgA:
undetectable		 3tm4B-3mpgA:
22.44
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.
4AZV_A_SAMA1474_1
(WBDD)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 6 TYR A 122
ASP A 150
GLN A 129
GLU A 180
 None
 1.34A 4azvA-3mpgA:
undetectable		 4azvA-3mpgA:
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.
4C1D_A_X8ZA350_1
(BETA-LACTAMASE CLASS
B VIM-2)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 9 HIS A 178
ASP A 151
HIS A 231
ASN A 277
HIS A  61
 ZN  A 430 (-3.3A)
ZN  A 429 ( 2.7A)
ZN  A 430 (-3.6A)
None
ZN  A 429 (-3.6A)
 1.21A 4c1dA-3mpgA:
undetectable		 4c1dA-3mpgA:
22.79
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.
4C1D_B_X8ZB350_1
(BETA-LACTAMASE CLASS
B VIM-2)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 10 HIS A 178
ASP A 151
HIS A 231
ASN A 277
HIS A  61
 ZN  A 430 (-3.3A)
ZN  A 429 ( 2.7A)
ZN  A 430 (-3.6A)
None
ZN  A 429 (-3.6A)
 1.19A 4c1dB-3mpgA:
undetectable		 4c1dB-3mpgA:
22.79
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.
4EQ4_B_SALB601_1
(4-SUBSTITUTED
BENZOATES-GLUTAMATE
LIGASE GH3.12)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 8 THR A 373
VAL A 117
THR A  87
GLY A  54
 None
 0.94A 4eq4B-3mpgA:
0.9		 4eq4B-3mpgA:
22.07
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.
4EXS_B_X8ZB301_1
(BETA-LACTAMASE NDM-1)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 8 HIS A 178
ASP A 151
CYH A 230
ASN A 277
HIS A  59
 ZN  A 430 (-3.3A)
ZN  A 429 ( 2.7A)
None
None
ZN  A 429 (-3.4A)
 1.30A 4exsB-3mpgA:
undetectable		 4exsB-3mpgA:
20.54
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.
4EXS_B_X8ZB301_1
(BETA-LACTAMASE NDM-1)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 8 HIS A 178
ASP A 151
HIS A 231
ASN A 277
HIS A  61
 ZN  A 430 (-3.3A)
ZN  A 429 ( 2.7A)
ZN  A 430 (-3.6A)
None
ZN  A 429 (-3.6A)
 1.33A 4exsB-3mpgA:
undetectable		 4exsB-3mpgA:
20.54
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.
4FE1_A_PQNA846_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1
PHOTOSYSTEM I
REACTION CENTER
SUBUNIT IX)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		6 / 10 PHE A 327
SER A 394
ALA A 306
GLY A 326
ALA A 174
MET A 173
 None
 1.30A 4fe1A-3mpgA:
undetectable
4fe1J-3mpgA:
undetectable		 4fe1A-3mpgA:
19.74
4fe1J-3mpgA:
7.08
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.
4H9M_A_HAEA929_1
(UREASE)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 5 HIS A  59
HIS A 178
HIS A 231
ASP A 304
 ZN  A 429 (-3.4A)
ZN  A 430 (-3.3A)
ZN  A 430 (-3.6A)
ZN  A 429 (-2.9A)
 0.58A 4h9mA-3mpgA:
22.3		 4h9mA-3mpgA:
20.36
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.
4HIV_D_DVAD2_0
(ACTINOMYCIN D)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		3 / 3 THR A 391
PRO A 389
THR A 390
 None
 0.86A 4hivD-3mpgA:
undetectable		 4hivD-3mpgA:
2.20
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.
4HVC_B_HFGB1602_0
(BIFUNCTIONAL
GLUTAMATE/PROLINE--T
RNA LIGASE)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 12 LEU A 260
GLU A 254
VAL A 255
PHE A  85
GLY A 366
 None
 1.18A 4hvcB-3mpgA:
undetectable		 4hvcB-3mpgA:
22.36
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.
4JVL_A_ESTA702_1
(ESTROGEN
SULFOTRANSFERASE)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 9 TYR A 122
PHE A 361
HIS A 228
ILE A  88
 None
 1.29A 4jvlA-3mpgA:
undetectable		 4jvlA-3mpgA:
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.
4KTT_C_SAMC404_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 8 ASP A  57
SER A 394
PHE A 327
ASP A 304
 None
None
None
ZN  A 429 (-2.9A)
 1.17A 4kttC-3mpgA:
undetectable		 4kttC-3mpgA:
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.
4L6V_1_PQN12001_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1
FUSION PROTEIN OF
PHOTOSYSTEM I
SUBUNIT III AND
SUBUNIT IX)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		6 / 11 PHE A 327
SER A 394
GLY A 396
ALA A 306
GLY A 326
ALA A 174
 None
 1.25A 4l6v1-3mpgA:
undetectable
4l6v6-3mpgA:
undetectable		 4l6v1-3mpgA:
20.95
4l6v6-3mpgA:
14.53
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.
4L6V_A_PQNA2001_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1
FUSION PROTEIN OF
PHOTOSYSTEM I
SUBUNIT III AND
SUBUNIT IX)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 9 PHE A 327
SER A 394
ALA A 306
GLY A 326
ALA A 174
 None
 1.23A 4l6va-3mpgA:
undetectable
4l6vf-3mpgA:
undetectable		 4l6va-3mpgA:
20.95
4l6vf-3mpgA:
14.53
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.
4NDN_A_SAMA407_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 8 ASP A  57
SER A 394
PHE A 327
ASP A 304
 None
None
None
ZN  A 429 (-2.9A)
 1.17A 4ndnA-3mpgA:
undetectable		 4ndnA-3mpgA:
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.
4NDN_C_SAMC405_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 7 ASP A  57
SER A 394
PHE A 327
ASP A 304
 None
None
None
ZN  A 429 (-2.9A)
 1.21A 4ndnC-3mpgA:
undetectable		 4ndnC-3mpgA:
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.
4ODJ_A_SAMA500_0
(S-ADENOSYLMETHIONINE
SYNTHASE)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 7 ASP A  57
SER A 394
PHE A 327
ASP A 304
 None
None
None
ZN  A 429 (-2.9A)
 1.19A 4odjA-3mpgA:
undetectable		 4odjA-3mpgA:
23.34
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.
4UBP_C_HAEC800_1
(PROTEIN (UREASE
(CHAIN C)))		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 6 HIS A  59
HIS A  61
HIS A 178
HIS A 231
ASP A 304
 ZN  A 429 (-3.4A)
ZN  A 429 (-3.6A)
ZN  A 430 (-3.3A)
ZN  A 430 (-3.6A)
ZN  A 429 (-2.9A)
 0.48A 4ubpC-3mpgA:
21.8		 4ubpC-3mpgA:
23.58
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.
4Y0Q_A_PX9A201_1
(BETA-LACTOGLOBULIN)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		3 / 3 LYS A 341
ILE A 343
ILE A 290
 None
 0.67A 4y0qA-3mpgA:
undetectable		 4y0qA-3mpgA:
17.68
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.
4YDQ_A_HFGA802_0
(PROLINE--TRNA LIGASE)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 12 LEU A 260
GLU A 254
VAL A 255
PHE A  85
GLY A 366
 None
 1.22A 4ydqA-3mpgA:
undetectable		 4ydqA-3mpgA:
21.54
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.
5A1I_A_ADNA407_1
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 8 ASP A  57
SER A 394
PHE A 327
ASP A 304
 None
None
None
ZN  A 429 (-2.9A)
 1.19A 5a1iA-3mpgA:
undetectable		 5a1iA-3mpgA:
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.
5A1I_A_SAMA405_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 7 ASP A  57
SER A 394
PHE A 327
ASP A 304
 None
None
None
ZN  A 429 (-2.9A)
 1.19A 5a1iA-3mpgA:
undetectable		 5a1iA-3mpgA:
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.
5EEN_B_5OGB804_1
(HDAC6 PROTEIN)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 12 SER A 233
HIS A  59
HIS A 231
ASP A 151
HIS A 178
 None
ZN  A 429 (-3.4A)
ZN  A 430 (-3.6A)
ZN  A 429 ( 2.7A)
ZN  A 430 (-3.3A)
 1.47A 5eenB-3mpgA:
undetectable		 5eenB-3mpgA:
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.
5EF8_A_LBHA2004_1
(HDAC6 PROTEIN)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 12 SER A 233
HIS A  59
HIS A 231
ASP A 151
HIS A 178
 None
ZN  A 429 (-3.4A)
ZN  A 430 (-3.6A)
ZN  A 429 ( 2.7A)
ZN  A 430 (-3.3A)
 1.43A 5ef8A-3mpgA:
undetectable		 5ef8A-3mpgA:
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.
5EF8_B_LBHB2004_1
(HDAC6 PROTEIN)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 12 SER A 233
HIS A  59
HIS A 231
ASP A 151
HIS A 178
 None
ZN  A 429 (-3.4A)
ZN  A 430 (-3.6A)
ZN  A 429 ( 2.7A)
ZN  A 430 (-3.3A)
 1.47A 5ef8B-3mpgA:
undetectable		 5ef8B-3mpgA:
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.
5I3B_B_HQEB303_1
(TYROSINASE)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 5 HIS A 228
HIS A  59
VAL A  58
ALA A 302
 None
ZN  A 429 (-3.4A)
None
None
 1.36A 5i3bB-3mpgA:
undetectable		 5i3bB-3mpgA:
20.59
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.
5L8R_A_PQNA844_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 9 PHE A 327
SER A 394
GLY A 396
ALA A 306
GLY A 326
 None
 1.10A 5l8rA-3mpgA:
undetectable		 5l8rA-3mpgA:
19.82
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.
5NFJ_A_SAMA501_0
(MITOCHONDRIAL
RIBONUCLEASE P
PROTEIN 1)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 12 THR A 345
ILE A 343
GLY A 342
LEU A 353
LEU A 334
 None
 0.98A 5nfjA-3mpgA:
undetectable		 5nfjA-3mpgA:
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.
5XIP_A_HFGA1003_0
(PROLYL-TRNA
SYNTHETASE, PUTATIVE)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 12 LEU A 293
VAL A 255
PHE A 331
THR A 377
GLY A  54
 None
 1.25A 5xipA-3mpgA:
undetectable		 5xipA-3mpgA:
21.20
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.
5XIP_C_HFGC1003_0
(PROLYL-TRNA
SYNTHETASE, PUTATIVE)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 12 LEU A 293
VAL A 255
PHE A 331
THR A 377
GLY A  54
 None
 1.20A 5xipC-3mpgA:
undetectable		 5xipC-3mpgA:
21.20
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.
5XIQ_D_HFGD1002_0
(PROLYL-TRNA
SYNTHETASE (PRORS))		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 12 LEU A 293
VAL A 255
PHE A 331
THR A 377
GLY A  54
 None
 1.19A 5xiqD-3mpgA:
undetectable		 5xiqD-3mpgA:
21.23
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.
5ZJ8_A_9DCA303_0
(METALLO-BETA-LACTAMA
SE TYPE 2)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 8 HIS A 178
ASP A 151
CYH A 230
HIS A  59
 ZN  A 430 (-3.3A)
ZN  A 429 ( 2.7A)
None
ZN  A 429 (-3.4A)
 0.98A 5zj8A-3mpgA:
undetectable		 5zj8A-3mpgA:
20.57
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.
5ZVG_A_SAMA401_0
(389AA LONG
HYPOTHETICAL
NUCLEOLAR PROTEIN)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 12 GLY A  83
ASP A 359
ALA A 358
ARG A 367
PRO A  53
 None
 1.17A 5zvgA-3mpgA:
undetectable		 5zvgA-3mpgA:
23.76
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.
5ZVG_B_SAMB401_0
(389AA LONG
HYPOTHETICAL
NUCLEOLAR PROTEIN)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		5 / 12 GLY A  83
ASP A 359
ALA A 358
ARG A 367
PRO A  53
 None
 1.17A 5zvgB-3mpgA:
undetectable		 5zvgB-3mpgA:
23.76
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.
6C06_D_FI8D1404_0
(DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA
DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA')		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 8 ILE A 324
THR A 325
ARG A  63
GLU A 312
 None
 1.02A 6c06C-3mpgA:
undetectable		 6c06C-3mpgA:
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.
6FBN_B_SAMB401_1
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 8 ASP A  57
SER A 394
PHE A 327
ASP A 304
 None
None
None
ZN  A 429 (-2.9A)
 1.17A 6fbnB-3mpgA:
undetectable		 6fbnB-3mpgA:
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.
6FBO_A_ADNA406_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 8 ASP A  57
SER A 394
PHE A 327
ASP A 304
 None
None
None
ZN  A 429 (-2.9A)
 1.19A 6fboA-3mpgA:
undetectable		 6fboA-3mpgA:
11.30
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.
6FCB_A_SAMA405_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 8 ASP A  57
SER A 394
PHE A 327
ASP A 304
 None
None
None
ZN  A 429 (-2.9A)
 1.21A 6fcbA-3mpgA:
undetectable		 6fcbA-3mpgA:
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.
6FCD_A_ADNA405_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 8 ASP A  57
SER A 394
PHE A 327
ASP A 304
 None
None
None
ZN  A 429 (-2.9A)
 1.20A 6fcdA-3mpgA:
undetectable		 6fcdA-3mpgA:
11.30
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.
6G6R_A_SAMA406_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 3mpg DIHYDROOROTASE
(Bacillus
anthracis) 		4 / 7 ASP A  57
SER A 394
PHE A 327
ASP A 304
 None
None
None
ZN  A 429 (-2.9A)
 1.18A 6g6rA-3mpgA:
undetectable		 6g6rA-3mpgA:
22.96