SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2v7b'

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)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		4 / 5 HIS A 203
SER A 410
LEU A 381
GLY A 333
 None
None
None
BEZ  A1529 (-3.6A)
 0.87A 1a4lB-2v7bA:
undetectable		 1a4lB-2v7bA:
22.30
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.
1RX3_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 12 ILE A 168
ALA A  85
MET A  80
ILE A  76
LEU A  65
 None
 1.18A 1rx3A-2v7bA:
undetectable		 1rx3A-2v7bA:
15.50
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.
1TD7_A_NFLA2001_1
(PHOSPHOLIPASE A2
ISOFORM 3)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 9 LEU A  54
ILE A 168
PHE A  61
TYR A  42
PHE A 164
 None
 1.38A 1td7A-2v7bA:
undetectable		 1td7A-2v7bA:
10.78
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.
1X70_B_715B801_2
(DIPEPTIDYL PEPTIDASE
IV)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		3 / 3 PHE A 341
TYR A 414
TYR A 422
 None
 0.92A 1x70B-2v7bA:
undetectable		 1x70B-2v7bA:
21.72
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.
1YA3_A_STRA1001_1
(MINERALOCORTICOID
RECEPTOR)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 12 LEU A  65
LEU A  91
ALA A  58
LEU A  86
MET A  80
 None
 1.27A 1ya3A-2v7bA:
undetectable		 1ya3A-2v7bA:
19.17
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.
1YA4_A_CTXA11_1
(CES1 PROTEIN)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		4 / 8 PRO A  87
GLY A 239
LEU A 256
PRO A 247
 None
 0.79A 1ya4A-2v7bA:
2.6		 1ya4A-2v7bA:
23.38
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.
1YA4_B_CTXB1283_1
(CES1 PROTEIN)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		4 / 7 PRO A  87
GLY A 239
LEU A 256
PRO A 247
 None
 0.81A 1ya4B-2v7bA:
undetectable		 1ya4B-2v7bA:
23.38
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.
1Z11_D_8MOD501_0
(CYTOCHROME P450,
FAMILY 2, SUBFAMILY
A, POLYPEPTIDE 6)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 10 PHE A  90
GLY A 241
THR A 211
LEU A 189
PHE A 187
 None
 1.10A 1z11D-2v7bA:
undetectable		 1z11D-2v7bA:
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.
2F9W_A_PAUA6002_0
(PANTOTHENATE KINASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		4 / 8 THR A 402
GLY A 411
ASP A 412
ILE A 408
 None
 0.88A 2f9wA-2v7bA:
undetectable
2f9wB-2v7bA:
undetectable		 2f9wA-2v7bA:
19.06
2f9wB-2v7bA:
19.06
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.
2QD3_B_CHDB504_0
(FERROCHELATASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		4 / 6 ILE A 255
ARG A 269
PRO A 153
SER A 151
 None
 1.30A 2qd3B-2v7bA:
4.0		 2qd3B-2v7bA:
21.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2V7B_A_BEZA1529_0
(BENZOATE-COENZYME A
LIGASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		9 / 9 PHE A 236
ALA A 237
TYR A 238
ALA A 308
GLY A 309
GLY A 333
HIS A 339
ILE A 340
LYS A 520
 BEZ  A1529 (-4.7A)
BEZ  A1529 ( 3.7A)
BEZ  A1529 (-4.3A)
BEZ  A1529 (-3.6A)
BEZ  A1529 (-3.5A)
BEZ  A1529 (-3.6A)
BEZ  A1529 (-3.8A)
BEZ  A1529 ( 4.9A)
BEZ  A1529 (-2.9A)
 0.00A 2v7bA-2v7bA:
74.1		 2v7bA-2v7bA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2V7B_B_BEZB1529_0
(BENZOATE-COENZYME A
LIGASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		9 / 9 PHE A 236
ALA A 237
TYR A 238
ALA A 308
GLY A 309
GLY A 333
HIS A 339
ILE A 340
LYS A 520
 BEZ  A1529 (-4.7A)
BEZ  A1529 ( 3.7A)
BEZ  A1529 (-4.3A)
BEZ  A1529 (-3.6A)
BEZ  A1529 (-3.5A)
BEZ  A1529 (-3.6A)
BEZ  A1529 (-3.8A)
BEZ  A1529 ( 4.9A)
BEZ  A1529 (-2.9A)
 0.09A 2v7bB-2v7bA:
72.2		 2v7bB-2v7bA:
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.
2VMY_B_FFOB505_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 12 GLY A 309
LEU A 284
SER A 307
ALA A 308
ASN A 242
 BEZ  A1529 (-3.5A)
None
None
BEZ  A1529 (-3.6A)
None
 1.04A 2vmyA-2v7bA:
3.4		 2vmyA-2v7bA:
22.30
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.
2W1B_A_DXCA2034_0
(ACRIFLAVIN
RESISTANCE PROTEIN B)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		3 / 3 PHE A 403
SER A 334
LEU A 338
 None
 0.75A 2w1bA-2v7bA:
3.0		 2w1bA-2v7bA:
21.22
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.
2ZXW_W_CHDW1060_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 1)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		4 / 7 ILE A 363
LEU A 342
PHE A 341
ARG A 409
 None
 0.97A 2zxwN-2v7bA:
undetectable
2zxwW-2v7bA:
undetectable		 2zxwN-2v7bA:
21.98
2zxwW-2v7bA:
8.35
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.
2ZZA_A_FOLA164_0
(DIHYDROFOLATE
REDUCTASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 12 ILE A 168
ALA A  85
MET A  80
ILE A  76
LEU A  65
 None
 1.31A 2zzaA-2v7bA:
undetectable		 2zzaA-2v7bA:
15.12
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.
2ZZA_B_FOLB164_0
(DIHYDROFOLATE
REDUCTASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 11 ILE A 168
ALA A  85
MET A  80
ILE A  76
LEU A  65
 None
 1.31A 2zzaB-2v7bA:
undetectable		 2zzaB-2v7bA:
15.12
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.
3A51_A_VDYA6178_1
(VITAMIN D
HYDROXYLASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 11 MET A  80
ILE A 125
LEU A  78
VAL A  70
LEU A  65
 None
 1.24A 3a51A-2v7bA:
undetectable		 3a51A-2v7bA:
23.06
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.
3AG2_W_CHDW1059_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 1)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		4 / 7 ILE A 363
LEU A 342
PHE A 341
ARG A 409
 None
 1.04A 3ag2N-2v7bA:
undetectable
3ag2W-2v7bA:
undetectable		 3ag2N-2v7bA:
21.98
3ag2W-2v7bA:
8.35
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.
3AG4_W_CHDW1059_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 1)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		4 / 7 ILE A 363
LEU A 342
PHE A 341
ARG A 409
 None
 1.01A 3ag4N-2v7bA:
undetectable
3ag4W-2v7bA:
undetectable		 3ag4N-2v7bA:
21.98
3ag4W-2v7bA:
8.35
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.
3B9L_A_AZZA1010_1
(SERUM ALBUMIN)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		4 / 8 LEU A 220
ILE A 304
ARG A 345
GLY A 347
 None
 0.80A 3b9lA-2v7bA:
undetectable		 3b9lA-2v7bA:
24.40
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.
3ELZ_C_CHDC150_0
(ILEAL BILE
ACID-BINDING PROTEIN)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 12 ASN A 242
VAL A 277
LEU A 338
ILE A 340
THR A 211
 None
None
None
BEZ  A1529 ( 4.9A)
None
 1.27A 3elzC-2v7bA:
undetectable		 3elzC-2v7bA:
15.25
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.
3FZG_A_SAMA300_0
(16S RRNA METHYLASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 12 HIS A 339
THR A 211
GLY A 243
GLY A 241
VAL A 277
 BEZ  A1529 (-3.8A)
None
None
None
None
 0.93A 3fzgA-2v7bA:
undetectable		 3fzgA-2v7bA:
17.62
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.
3OU6_C_SAMC300_0
(SAM-DEPENDENT
METHYLTRANSFERASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 12 LEU A 116
TYR A 112
ALA A 126
LEU A 148
ALA A 129
 None
 1.23A 3ou6C-2v7bA:
undetectable		 3ou6C-2v7bA:
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.
3OU7_C_SAMC300_0
(SAM-DEPENDENT
METHYLTRANSFERASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 12 LEU A 116
TYR A 112
ALA A 126
LEU A 148
ALA A 129
 None
 1.20A 3ou7C-2v7bA:
undetectable		 3ou7C-2v7bA:
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.
3QL0_A_FOLA160_0
(DIHYDROFOLATE
REDUCTASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 12 ILE A 168
ALA A  85
MET A  80
ILE A  76
LEU A  65
 None
 1.17A 3ql0A-2v7bA:
undetectable		 3ql0A-2v7bA:
15.50
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.
3T3R_A_9PLA501_1
(CYTOCHROME P450 2A6)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 11 PHE A  90
GLY A 241
THR A 211
LEU A 189
PHE A 187
 None
 1.07A 3t3rA-2v7bA:
undetectable		 3t3rA-2v7bA:
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.
3U5J_A_08HA1_1
(BROMODOMAIN-CONTAINI
NG PROTEIN 4)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		4 / 7 LEU A  65
LEU A  68
ILE A 125
MET A  80
 None
 0.88A 3u5jA-2v7bA:
undetectable		 3u5jA-2v7bA:
13.04
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.
3VNS_A_DVAA602_0
(NRPS ADENYLATION
PROTEIN CYTC1)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		4 / 7 PHE A 236
GLY A 309
THR A 335
LYS A 520
 BEZ  A1529 (-4.7A)
BEZ  A1529 (-3.5A)
None
BEZ  A1529 (-2.9A)
 0.70A 3vnsA-2v7bA:
43.9		 3vnsA-2v7bA:
28.55
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4EAT_A_BEZA1000_0
(BENZOATE-COENZYME A
LIGASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		7 / 7 ALA A 237
TYR A 238
ALA A 308
GLY A 309
ILE A 332
GLY A 333
ILE A 340
 BEZ  A1529 ( 3.7A)
BEZ  A1529 (-4.3A)
BEZ  A1529 (-3.6A)
BEZ  A1529 (-3.5A)
None
BEZ  A1529 (-3.6A)
BEZ  A1529 ( 4.9A)
 0.24A 4eatA-2v7bA:
62.0		 4eatA-2v7bA:
60.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4EAT_B_BEZB1000_0
(BENZOATE-COENZYME A
LIGASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		7 / 9 ALA A 237
TYR A 238
ALA A 308
GLY A 309
GLY A 333
HIS A 339
LYS A 520
 BEZ  A1529 ( 3.7A)
BEZ  A1529 (-4.3A)
BEZ  A1529 (-3.6A)
BEZ  A1529 (-3.5A)
BEZ  A1529 (-3.6A)
BEZ  A1529 (-3.8A)
BEZ  A1529 (-2.9A)
 1.18A 4eatB-2v7bA:
62.1		 4eatB-2v7bA:
60.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4EAT_B_BEZB1000_0
(BENZOATE-COENZYME A
LIGASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		8 / 9 ALA A 237
TYR A 238
ALA A 308
GLY A 309
ILE A 332
GLY A 333
HIS A 339
ILE A 340
 BEZ  A1529 ( 3.7A)
BEZ  A1529 (-4.3A)
BEZ  A1529 (-3.6A)
BEZ  A1529 (-3.5A)
None
BEZ  A1529 (-3.6A)
BEZ  A1529 (-3.8A)
BEZ  A1529 ( 4.9A)
 0.27A 4eatB-2v7bA:
62.1		 4eatB-2v7bA:
60.56
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.
4EJJ_D_NCTD501_1
(CYTOCHROME P450 2A6)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		4 / 7 PHE A  90
GLY A 241
LEU A 189
PHE A 187
 None
 0.90A 4ejjD-2v7bA:
undetectable		 4ejjD-2v7bA:
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.
4ENH_A_FVXA602_1
(CHOLESTEROL
24-HYDROXYLASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 12 LEU A 167
ALA A 123
ALA A  93
GLY A  97
ALA A  64
 None
 1.14A 4enhA-2v7bA:
undetectable		 4enhA-2v7bA:
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.
4G0V_A_MIXA1301_1
(DNA TOPOISOMERASE
2-BETA)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		4 / 7 GLY A 352
ASN A 419
GLU A 350
GLN A 450
 None
 0.71A 4g0vA-2v7bA:
undetectable		 4g0vA-2v7bA:
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.
4GH8_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 12 ILE A 168
ALA A  85
MET A  80
ILE A  76
LEU A  65
 None
 0.98A 4gh8A-2v7bA:
undetectable		 4gh8A-2v7bA:
16.07
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.
4MWR_A_ZMRA513_2
(NEURAMINIDASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		4 / 5 LEU A 432
ASP A 430
ARG A 523
ILE A 521
 None
 1.47A 4mwrA-2v7bA:
undetectable		 4mwrA-2v7bA:
21.11
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.
4O2B_B_LOCB503_2
(TUBULIN BETA-2B
CHAIN)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 12 LEU A 167
LEU A  65
ALA A 123
ILE A 125
ILE A  76
 None
 0.88A 4o2bB-2v7bA:
undetectable		 4o2bB-2v7bA:
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.
4O2B_D_LOCD503_2
(TUBULIN BETA-2B
CHAIN)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 12 LEU A 167
LEU A  65
ALA A 123
ILE A 125
ILE A  76
 None
 0.89A 4o2bD-2v7bA:
undetectable		 4o2bD-2v7bA:
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.
4P6S_A_DAHA304_1
(TYROSINASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		4 / 5 ASN A 419
LEU A 417
GLU A 350
THR A 353
 None
 1.20A 4p6sA-2v7bA:
undetectable		 4p6sA-2v7bA:
18.90
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.
4RGC_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 12 ILE A 168
ALA A  85
MET A  80
ILE A  76
LEU A  65
 None
 1.17A 4rgcA-2v7bA:
undetectable		 4rgcA-2v7bA:
15.50
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.
4XMF_A_HSMA202_1
(NITROPHORIN-7)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		3 / 3 ASP A 226
LEU A 220
GLY A 221
 None
 0.56A 4xmfA-2v7bA:
undetectable		 4xmfA-2v7bA:
17.98
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.
4YPM_A_BO2A801_1
(LON PROTEASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 12 ALA A 389
THR A 335
THR A 201
GLY A 385
PRO A 386
 None
 1.20A 4ypmA-2v7bA:
undetectable		 4ypmA-2v7bA:
21.43
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.
4YPM_A_BO2A801_1
(LON PROTEASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 12 THR A 335
THR A 201
THR A 402
GLY A 385
PRO A 386
 None
 1.19A 4ypmA-2v7bA:
undetectable		 4ypmA-2v7bA:
21.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ZJZ_A_BEZA1001_0
(BENZOATE-COENZYME A
LIGASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 8 ALA A 231
PRO A 261
PHE A 278
GLY A 280
MET A 288
 None
 0.55A 4zjzA-2v7bA:
62.1		 4zjzA-2v7bA:
60.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ZJZ_B_BEZB601_0
(BENZOATE-COENZYME A
LIGASE)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 8 ALA A 231
PRO A 261
PHE A 278
GLY A 280
MET A 288
 None
 0.55A 4zjzB-2v7bA:
25.0		 4zjzB-2v7bA:
60.56
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.
4ZXI_A_GLYA1402_0
(TYROCIDINE
SYNTHETASE 3)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		4 / 7 PHE A 236
GLY A 309
THR A 335
LYS A 520
 BEZ  A1529 (-4.7A)
BEZ  A1529 (-3.5A)
None
BEZ  A1529 (-2.9A)
 0.78A 4zxiA-2v7bA:
41.7		 4zxiA-2v7bA:
18.33
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.
5EYP_B_LOCB502_2
(TUBULIN BETA CHAIN)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 12 LEU A 167
LEU A  65
ALA A 123
ILE A 125
ILE A  76
 None
 0.84A 5eypB-2v7bA:
undetectable		 5eypB-2v7bA:
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.
5HBS_A_RTLA201_1
(RETINOL-BINDING
PROTEIN 1)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		4 / 8 LEU A 365
LEU A 417
THR A 354
TYR A 424
 None
 1.17A 5hbsA-2v7bA:
undetectable		 5hbsA-2v7bA:
13.05
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.
5ITZ_B_LOCB502_1
(TUBULIN BETA-2B
CHAIN)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 12 LEU A 167
ALA A  64
LEU A  65
ALA A 123
ILE A 125
 None
 1.04A 5itzB-2v7bA:
undetectable		 5itzB-2v7bA:
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.
5MIO_B_LOCB502_1
(TUBULIN BETA CHAIN)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 12 LEU A 167
LEU A  65
ALA A 123
ILE A 125
ILE A  76
 None
 0.87A 5mioB-2v7bA:
2.0		 5mioB-2v7bA:
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.
5N9X_A_THRA601_0
(ADENYLATION DOMAIN)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		4 / 7 PHE A 236
GLY A 333
HIS A 339
LYS A 520
 BEZ  A1529 (-4.7A)
BEZ  A1529 (-3.6A)
BEZ  A1529 (-3.8A)
BEZ  A1529 (-2.9A)
 0.92A 5n9xA-2v7bA:
43.8		 5n9xA-2v7bA:
28.60
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.
5TL8_A_X2NA502_2
(PROTEIN CYP51)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		4 / 6 PRO A 247
PRO A  87
PHE A  90
LEU A  86
 None
 1.07A 5tl8A-2v7bA:
undetectable		 5tl8A-2v7bA:
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.
5XDX_W_CHDW101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT VIIA-HEART)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		4 / 8 ILE A 363
LEU A 342
PHE A 341
ARG A 409
 None
 0.94A 5xdxN-2v7bA:
undetectable
5xdxW-2v7bA:
undetectable		 5xdxN-2v7bA:
21.98
5xdxW-2v7bA:
8.35
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.
5XIW_B_LOCB504_2
(TUBULIN BETA CHAIN)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 12 LEU A 167
LEU A  65
ALA A 123
ILE A 125
ILE A  76
 None
 0.88A 5xiwB-2v7bA:
undetectable		 5xiwB-2v7bA:
7.98
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.
5XIW_D_LOCD503_2
(TUBULIN BETA CHAIN)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 12 LEU A 167
LEU A  65
ALA A 123
ILE A 125
ILE A  76
 None
 0.85A 5xiwD-2v7bA:
undetectable		 5xiwD-2v7bA:
7.98
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.
6DLZ_A_CYZA1302_0
(GLUTAMATE RECEPTOR
2,VOLTAGE-DEPENDENT
CALCIUM CHANNEL
GAMMA-2 SUBUNIT)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 10 SER A 387
LEU A 381
SER A 410
ILE A 332
GLY A 333
 None
None
None
None
BEZ  A1529 (-3.6A)
 1.12A 6dlzA-2v7bA:
4.0
6dlzD-2v7bA:
2.7		 6dlzA-2v7bA:
11.30
6dlzD-2v7bA:
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.
6DLZ_C_CYZC1302_0
(GLUTAMATE RECEPTOR
2,VOLTAGE-DEPENDENT
CALCIUM CHANNEL
GAMMA-2 SUBUNIT)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 10 ILE A 332
GLY A 333
SER A 387
LEU A 381
SER A 410
 None
BEZ  A1529 (-3.6A)
None
None
None
 1.13A 6dlzB-2v7bA:
3.0
6dlzC-2v7bA:
3.8		 6dlzB-2v7bA:
11.30
6dlzC-2v7bA:
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.
6DM1_A_CYZA1302_0
(GLUTAMATE RECEPTOR
2,VOLTAGE-DEPENDENT
CALCIUM CHANNEL
GAMMA-2 SUBUNIT)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 10 SER A 387
LEU A 381
SER A 410
ILE A 332
GLY A 333
 None
None
None
None
BEZ  A1529 (-3.6A)
 1.13A 6dm1A-2v7bA:
3.8
6dm1D-2v7bA:
3.0		 6dm1A-2v7bA:
11.30
6dm1D-2v7bA:
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.
6DM1_C_CYZC1302_0
(GLUTAMATE RECEPTOR
2,VOLTAGE-DEPENDENT
CALCIUM CHANNEL
GAMMA-2 SUBUNIT)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		5 / 10 ILE A 332
GLY A 333
SER A 387
LEU A 381
SER A 410
 None
BEZ  A1529 (-3.6A)
None
None
None
 1.13A 6dm1B-2v7bA:
2.7
6dm1C-2v7bA:
3.7		 6dm1B-2v7bA:
11.30
6dm1C-2v7bA:
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.
6FGD_A_ACTA825_0
(GEPHYRIN)		 2v7b BENZOATE-COENZYME A
LIGASE
(Paraburkholderia
xenovorans) 		3 / 3 LYS A 413
VAL A 378
ASP A 380
 None
 0.28A 6fgdA-2v7bA:
3.5		 6fgdA-2v7bA:
22.88