SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1r3n'

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_A_DCFA353_1
(ADENOSINE DEAMINASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		5 / 12 HIS A 421
PHE A 412
ALA A 395
GLU A 159
ASP A 125
 ZN  A 501 (-3.2A)
None
None
ZN  A 500 ( 3.9A)
ZN  A 501 ( 2.3A)
 1.18A 1a4lA-1r3nA:
undetectable		 1a4lA-1r3nA:
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.
1A4L_C_DCFC1353_1
(ADENOSINE DEAMINASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		5 / 12 HIS A 421
PHE A 412
ALA A 395
GLU A 159
ASP A 125
 ZN  A 501 (-3.2A)
None
None
ZN  A 500 ( 3.9A)
ZN  A 501 ( 2.3A)
 1.19A 1a4lC-1r3nA:
undetectable		 1a4lC-1r3nA:
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.
1HK5_A_T44A1008_1
(SERUM ALBUMIN)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		5 / 10 GLU A 430
ASN A 434
LYS A 437
VAL A 438
VAL A 388
 None
 0.89A 1hk5A-1r3nA:
0.0		 1hk5A-1r3nA:
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.
1KIA_B_SAMB1293_1
(GLYCINE
N-METHYLTRANSFERASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		4 / 5 ASP A 398
SER A 113
ASN A  95
SER A 167
 None
 1.27A 1kiaB-1r3nA:
undetectable		 1kiaB-1r3nA:
21.61
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.
1KIA_C_SAMC2293_1
(GLYCINE
N-METHYLTRANSFERASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		4 / 6 ASP A 398
SER A 113
ASN A  95
SER A 167
 None
 1.25A 1kiaC-1r3nA:
undetectable		 1kiaC-1r3nA:
21.61
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.
1S19_A_MC9A500_1
(VITAMIN D3 RECEPTOR)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		4 / 5 SER A 172
ARG A 166
HIS A 226
HIS A 114
 None
None
ZN  A 500 (-3.2A)
ZN  A 500 (-3.2A)
 1.43A 1s19A-1r3nA:
undetectable		 1s19A-1r3nA:
20.92
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.
1U65_A_CP0A1000_1
(ACETYLCHOLINESTERASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		5 / 11 GLN A 247
GLU A 160
LEU A 233
ASP A 235
HIS A 421
 None
ZN  A 501 (-2.0A)
None
None
ZN  A 501 (-3.2A)
 1.49A 1u65A-1r3nA:
0.0		 1u65A-1r3nA:
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.
1UWH_B_BAXB1723_2
(B-RAF PROTO-ONCOGENE
SERINE/THREONINE-PRO
TEIN KINASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		4 / 6 ILE A 372
VAL A 375
ILE A 227
ILE A  39
 None
 0.77A 1uwhB-1r3nA:
undetectable		 1uwhB-1r3nA:
21.44
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.
1V8B_A_ADNA502_2
(ADENOSYLHOMOCYSTEINA
SE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		3 / 3 GLU A 425
GLU A 431
LEU A 225
 None
 0.57A 1v8bA-1r3nA:
undetectable		 1v8bA-1r3nA:
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.
1V8B_B_ADNB1502_2
(ADENOSYLHOMOCYSTEINA
SE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		3 / 3 GLU A 425
GLU A 431
LEU A 225
 None
 0.56A 1v8bB-1r3nA:
undetectable		 1v8bB-1r3nA:
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.
2BXF_B_DZPB2001_1
(SERUM ALBUMIN)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		5 / 12 LEU A 440
ILE A 443
LEU A 134
VAL A 153
LEU A 137
 None
 1.27A 2bxfB-1r3nA:
undetectable		 2bxfB-1r3nA:
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.
2IGT_C_SAMC1003_0
(SAM DEPENDENT
METHYLTRANSFERASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		5 / 12 HIS A 222
PHE A  97
PHE A 157
ALA A  65
GLY A 161
 None
 1.09A 2igtC-1r3nA:
undetectable		 2igtC-1r3nA:
21.38
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.
2PGF_A_ADNA501_1
(ADENOSINE DEAMINASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		5 / 12 HIS A 114
ASP A 116
GLY A 129
HIS A 226
SER A 399
 ZN  A 500 (-3.2A)
None
None
ZN  A 500 (-3.2A)
None
 1.43A 2pgfA-1r3nA:
undetectable		 2pgfA-1r3nA:
20.71
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.
2W9H_A_TOPA1160_1
(DIHYDROFOLATE
REDUCTASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		5 / 10 LEU A 137
LEU A 439
VAL A 151
ILE A 444
PHE A 140
 None
 1.13A 2w9hA-1r3nA:
undetectable		 2w9hA-1r3nA:
14.98
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.
3A50_C_VD3C2001_1
(VITAMIN D
HYDROXYLASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		5 / 11 ILE A 432
ASN A 422
LEU A 128
ILE A 127
LEU A  40
 None
 1.22A 3a50C-1r3nA:
undetectable		 3a50C-1r3nA:
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.
3A50_E_VD3E2001_1
(VITAMIN D
HYDROXYLASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		5 / 12 ILE A 432
ASN A 422
LEU A 128
ILE A 127
LEU A  40
 None
 1.27A 3a50E-1r3nA:
undetectable		 3a50E-1r3nA:
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.
3A51_D_VDYD6178_1
(VITAMIN D
HYDROXYLASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		5 / 12 ILE A 432
ASN A 422
LEU A 128
ILE A 127
LEU A  40
 None
 1.16A 3a51D-1r3nA:
undetectable		 3a51D-1r3nA:
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.
3EEY_A_SAMA300_0
(PUTATIVE RRNA
METHYLASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		5 / 12 GLY A  66
ASP A 116
ILE A 207
GLY A 208
ASN A 158
 None
 0.85A 3eeyA-1r3nA:
undetectable		 3eeyA-1r3nA:
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.
3EEY_B_SAMB300_0
(PUTATIVE RRNA
METHYLASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		5 / 12 GLY A  66
ASP A 116
ILE A 207
GLY A 208
ASN A 158
 None
 0.85A 3eeyB-1r3nA:
undetectable		 3eeyB-1r3nA:
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.
3EEY_C_SAMC300_0
(PUTATIVE RRNA
METHYLASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		5 / 12 GLY A  66
ASP A 116
ILE A 207
GLY A 208
ASN A 158
 None
 0.85A 3eeyC-1r3nA:
undetectable		 3eeyC-1r3nA:
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.
3EEY_D_SAMD300_0
(PUTATIVE RRNA
METHYLASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		5 / 12 GLY A  66
ASP A 116
ILE A 207
GLY A 208
ASN A 158
 None
 0.87A 3eeyD-1r3nA:
undetectable		 3eeyD-1r3nA:
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.
3EEY_E_SAME300_0
(PUTATIVE RRNA
METHYLASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		5 / 12 GLY A  66
ASP A 116
ILE A 207
GLY A 208
ASN A 158
 None
 0.87A 3eeyE-1r3nA:
undetectable		 3eeyE-1r3nA:
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.
3EEY_F_SAMF300_0
(PUTATIVE RRNA
METHYLASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		5 / 12 GLY A  66
ASP A 116
ILE A 207
GLY A 208
ASN A 158
 None
 0.87A 3eeyF-1r3nA:
undetectable		 3eeyF-1r3nA:
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.
3EEY_H_SAMH300_0
(PUTATIVE RRNA
METHYLASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		5 / 12 GLY A  66
ASP A 116
ILE A 207
GLY A 208
ASN A 158
 None
 0.87A 3eeyH-1r3nA:
undetectable		 3eeyH-1r3nA:
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.
3EEY_I_SAMI300_0
(PUTATIVE RRNA
METHYLASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		5 / 12 GLY A  66
ASP A 116
ILE A 207
GLY A 208
ASN A 158
 None
 0.87A 3eeyI-1r3nA:
undetectable		 3eeyI-1r3nA:
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.
3EEY_J_SAMJ300_0
(PUTATIVE RRNA
METHYLASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		5 / 12 GLY A  66
ASP A 116
ILE A 207
GLY A 208
ASN A 158
 None
 0.85A 3eeyJ-1r3nA:
2.8		 3eeyJ-1r3nA:
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.
3HGX_A_SALA102_1
(SALICYLATE
BIOSYNTHESIS PROTEIN
PCHB)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		4 / 7 ARG A  74
VAL A  90
TYR A 206
ILE A 207
 None
 0.97A 3hgxA-1r3nA:
undetectable		 3hgxA-1r3nA:
12.53
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.
3R55_A_PZAA598_0
(LACTOPEROXIDASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		3 / 3 GLU A 228
PHE A 412
GLN A 229
 None
None
ZN  A 501 (-4.1A)
 1.00A 3r55A-1r3nA:
undetectable		 3r55A-1r3nA:
22.03
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.
3REM_A_SALA301_1
(SALICYLATE
BIOSYNTHESIS PROTEIN
PCHB)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		4 / 8 ARG A  74
VAL A  90
TYR A 206
ILE A 207
 None
 0.94A 3remA-1r3nA:
undetectable		 3remA-1r3nA:
12.31
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.
3REM_B_SALB301_1
(SALICYLATE
BIOSYNTHESIS PROTEIN
PCHB)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		4 / 8 ARG A  74
VAL A  90
TYR A 206
ILE A 207
 None
 0.96A 3remB-1r3nA:
undetectable		 3remB-1r3nA:
12.31
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.
3W9T_B_W9TB501_1
(HEMOLYTIC LECTIN
CEL-III)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		4 / 5 SER A 171
GLY A 170
TRP A 174
ASP A  91
 None
 1.44A 3w9tB-1r3nA:
0.0		 3w9tB-1r3nA:
19.72
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.
3W9T_C_W9TC1003_1
(HEMOLYTIC LECTIN
CEL-III)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		4 / 5 SER A 171
GLY A 170
TRP A 174
ASP A  91
 None
 1.43A 3w9tC-1r3nA:
0.0		 3w9tC-1r3nA:
19.72
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.
3W9T_D_W9TD501_1
(HEMOLYTIC LECTIN
CEL-III)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		4 / 5 SER A 171
GLY A 170
TRP A 174
ASP A  91
 None
 1.43A 3w9tD-1r3nA:
0.0		 3w9tD-1r3nA:
19.72
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.
4AE1_A_NCAA1536_0
(DIPHTHERIA TOXIN)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		4 / 6 HIS A 323
GLY A 294
ALA A 289
GLU A 335
 None
 0.96A 4ae1A-1r3nA:
undetectable		 4ae1A-1r3nA:
23.52
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.
4HVR_A_SALA203_1
(3-HYDROXYANTHRANILAT
E 3,4-DIOXYGENASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		4 / 7 ASP A 125
GLU A 160
HIS A 421
GLU A 159
 ZN  A 501 ( 2.3A)
ZN  A 501 (-2.0A)
ZN  A 501 (-3.2A)
ZN  A 500 ( 3.9A)
 1.11A 4hvrA-1r3nA:
undetectable		 4hvrA-1r3nA:
16.45
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.
4HVR_A_SALA203_1
(3-HYDROXYANTHRANILAT
E 3,4-DIOXYGENASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		4 / 7 HIS A 421
ASP A 125
GLU A 160
GLU A 159
 ZN  A 501 (-3.2A)
ZN  A 501 ( 2.3A)
ZN  A 501 (-2.0A)
ZN  A 500 ( 3.9A)
 1.10A 4hvrA-1r3nA:
undetectable		 4hvrA-1r3nA:
16.45
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.
4HYT_A_OBNA1104_2
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		4 / 5 ASP A  91
ASN A 217
ILE A 219
VAL A  99
 None
 1.23A 4hytA-1r3nA:
0.0		 4hytA-1r3nA:
18.01
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.
4PQA_A_X8ZA401_1
(SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		6 / 11 HIS A 114
ASP A 125
GLU A 159
GLU A 160
GLY A 394
HIS A 421
 ZN  A 500 (-3.2A)
ZN  A 501 ( 2.3A)
ZN  A 500 ( 3.9A)
ZN  A 501 (-2.0A)
None
ZN  A 501 (-3.2A)
 0.44A 4pqaA-1r3nA:
28.7		 4pqaA-1r3nA:
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.
4RUJ_A_VDXA501_1
(VITAMIN D3 RECEPTOR
A)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		5 / 12 SER A 172
ARG A 166
SER A 362
HIS A 226
HIS A 114
 None
None
None
ZN  A 500 (-3.2A)
ZN  A 500 (-3.2A)
 1.49A 4rujA-1r3nA:
0.0		 4rujA-1r3nA:
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.
4XE5_A_OBNA1104_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		5 / 12 GLU A 160
GLY A 129
ALA A 132
PHE A 412
ILE A 432
 ZN  A 501 (-2.0A)
None
None
None
None
 1.29A 4xe5A-1r3nA:
undetectable		 4xe5A-1r3nA:
19.39
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.
5ENT_C_MIYC901_1
(MULTIDRUG EFFLUX
PUMP SUBUNIT
ACRB,MULTIDRUG
EFFLUX PUMP SUBUNIT
ACRB)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		5 / 9 SER A 427
GLN A 387
GLY A 241
GLU A 228
ILE A 411
 None
 1.09A 5entC-1r3nA:
5.2		 5entC-1r3nA:
22.47
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.
5H8T_A_RTLA201_1
(RETINOL-BINDING
PROTEIN 1)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		4 / 6 LEU A 128
THR A  38
GLN A  45
MET A  73
 None
 1.32A 5h8tA-1r3nA:
0.0		 5h8tA-1r3nA:
14.41
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.
5NCD_A_ACTA301_0
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		4 / 6 ASP A 125
HIS A 226
HIS A 114
HIS A 421
 ZN  A 501 ( 2.3A)
ZN  A 500 (-3.2A)
ZN  A 500 (-3.2A)
ZN  A 501 (-3.2A)
 0.89A 5ncdA-1r3nA:
undetectable
5ncdD-1r3nA:
undetectable		 5ncdA-1r3nA:
21.05
5ncdD-1r3nA:
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.
5NCD_C_ACTC301_0
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		4 / 6 ASP A 125
HIS A 226
HIS A 114
HIS A 421
 ZN  A 501 ( 2.3A)
ZN  A 500 (-3.2A)
ZN  A 500 (-3.2A)
ZN  A 501 (-3.2A)
 0.84A 5ncdB-1r3nA:
undetectable
5ncdC-1r3nA:
undetectable		 5ncdB-1r3nA:
21.05
5ncdC-1r3nA:
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.
5NEK_B_AZMB302_1
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		4 / 8 ASP A 125
HIS A 226
HIS A 114
HIS A 421
 ZN  A 501 ( 2.3A)
ZN  A 500 (-3.2A)
ZN  A 500 (-3.2A)
ZN  A 501 (-3.2A)
 0.97A 5nekB-1r3nA:
undetectable		 5nekB-1r3nA:
13.55
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.
5NEK_D_AZMD302_1
(PEPTIDOGLYCAN
N-ACETYLGLUCOSAMINE
DEACETYLASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		4 / 8 ASP A 125
HIS A 226
HIS A 114
HIS A 421
 ZN  A 501 ( 2.3A)
ZN  A 500 (-3.2A)
ZN  A 500 (-3.2A)
ZN  A 501 (-3.2A)
 0.84A 5nekD-1r3nA:
undetectable		 5nekD-1r3nA:
13.55
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.
5TDM_A_ADNA904_1
(ATP-CITRATE SYNTHASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		4 / 4 THR A  67
ASP A  70
ARG A  63
LEU A  64
 None
 1.07A 5tdmA-1r3nA:
0.1		 5tdmA-1r3nA:
23.81
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.
5TDZ_A_ADNA905_1
(ATP-CITRATE SYNTHASE)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		4 / 6 THR A  67
ASP A  70
ARG A  63
LEU A  64
 None
 1.17A 5tdzA-1r3nA:
undetectable		 5tdzA-1r3nA:
23.81
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.
6B5V_B_ECLB1001_1
(TRANSIENT RECEPTOR
POTENTIAL CATION
CHANNEL SUBFAMILY V
MEMBER 5)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		4 / 7 PHE A 340
ILE A 344
LEU A 352
ILE A 282
 None
 0.76A 6b5vA-1r3nA:
undetectable
6b5vB-1r3nA:
undetectable		 6b5vA-1r3nA:
11.41
6b5vB-1r3nA:
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.
6MN5_B_LLLB301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 1r3n BETA-ALANINE
SYNTHASE
(Lachancea
kluyveri) 		4 / 7 ASP A 142
ARG A 138
GLU A 135
GLU A  41
 None
 1.21A 6mn5B-1r3nA:
undetectable		 6mn5B-1r3nA:
12.81