SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3u4a'

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.
1CQE_A_FLPA1650_1
(PROTEIN
(PROSTAGLANDIN H2
SYNTHASE-1))		 3u4a JMB19063
(compost
metagenome) 		5 / 12 VAL A 518
LEU A 517
LEU A 555
GLY A 387
LEU A 412
 None
 1.02A 1cqeA-3u4aA:
undetectable		 1cqeA-3u4aA:
21.55
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.
1CQE_B_FLPB2650_1
(PROTEIN
(PROSTAGLANDIN H2
SYNTHASE-1))		 3u4a JMB19063
(compost
metagenome) 		5 / 12 VAL A 518
LEU A 517
LEU A 555
GLY A 387
LEU A 412
 None
 1.03A 1cqeB-3u4aA:
undetectable		 1cqeB-3u4aA:
21.55
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.
1GMK_A_DVAA8_0
(GRAMICIDIN A)		 3u4a JMB19063
(compost
metagenome) 		3 / 4 VAL A 143
TRP A 400
TRP A 140
 None
 1.35A 1gmkA-3u4aA:
undetectable
1gmkB-3u4aA:
undetectable		 1gmkA-3u4aA:
1.89
1gmkB-3u4aA:
1.89
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.
1L5K_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 3u4a JMB19063
(compost
metagenome) 		5 / 9 GLY A 141
GLY A 148
LEU A  97
SER A 135
GLY A 146
 None
 1.25A 1l5kA-3u4aA:
undetectable		 1l5kA-3u4aA:
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.
1L5L_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 3u4a JMB19063
(compost
metagenome) 		5 / 9 GLY A 141
GLY A 148
LEU A  97
SER A 135
GLY A 146
 None
 1.24A 1l5lA-3u4aA:
undetectable		 1l5lA-3u4aA:
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.
1L5M_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 3u4a JMB19063
(compost
metagenome) 		5 / 9 GLY A 141
GLY A 148
LEU A  97
SER A 135
GLY A 146
 None
 1.23A 1l5mA-3u4aA:
undetectable		 1l5mA-3u4aA:
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.
1MT1_G_AG2G7003_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN)		 3u4a JMB19063
(compost
metagenome) 		4 / 6 LEU A  23
ASP A 289
GLY A 256
ARG A 248
 None
 0.90A 1mt1G-3u4aA:
undetectable
1mt1J-3u4aA:
undetectable		 1mt1G-3u4aA:
5.93
1mt1J-3u4aA:
7.93
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.
1MT1_K_AG2K7002_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN)		 3u4a JMB19063
(compost
metagenome) 		4 / 7 ARG A 248
LEU A  23
ASP A 289
GLY A 256
 None
 0.89A 1mt1H-3u4aA:
undetectable
1mt1K-3u4aA:
undetectable		 1mt1H-3u4aA:
7.93
1mt1K-3u4aA:
5.93
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.
1MX1_C_THAC3_1
(LIVER
CARBOXYLESTERASE I)		 3u4a JMB19063
(compost
metagenome) 		5 / 12 LEU A 412
VAL A 374
LEU A 375
LEU A 377
LEU A 385
 None
 0.91A 1mx1C-3u4aA:
undetectable		 1mx1C-3u4aA:
22.95
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.
1N13_H_AG2H7012_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN)		 3u4a JMB19063
(compost
metagenome) 		4 / 6 ARG A 248
LEU A  23
ASP A 289
GLY A 256
 None
 0.93A 1n13H-3u4aA:
undetectable
1n13K-3u4aA:
undetectable		 1n13H-3u4aA:
7.93
1n13K-3u4aA:
5.93
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.
1N13_J_AG2J7013_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN)		 3u4a JMB19063
(compost
metagenome) 		4 / 7 LEU A  23
ASP A 289
GLY A 256
ARG A 248
 None
 0.94A 1n13G-3u4aA:
undetectable
1n13J-3u4aA:
undetectable		 1n13G-3u4aA:
5.93
1n13J-3u4aA:
7.93
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.
1XR2_B_C2FB1201_0
(5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE)		 3u4a JMB19063
(compost
metagenome) 		4 / 8 THR A 197
SER A 491
ARG A 139
GLU A 145
 None
 1.44A 1xr2B-3u4aA:
4.6		 1xr2B-3u4aA:
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.
2AKE_A_TRPA479_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 3u4a JMB19063
(compost
metagenome) 		5 / 12 THR A 521
GLY A 522
GLY A 487
THR A 399
GLU A 484
 None
 1.32A 2akeA-3u4aA:
undetectable		 2akeA-3u4aA:
19.54
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.
2AVD_B_SAMB601_1
(CATECHOL-O-METHYLTRA
NSFERASE)		 3u4a JMB19063
(compost
metagenome) 		3 / 3 SER A 649
GLU A 656
ASP A 727
 None
 0.60A 2avdB-3u4aA:
undetectable		 2avdB-3u4aA:
15.06
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.
2AYL_B_FLPB2701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 3u4a JMB19063
(compost
metagenome) 		5 / 12 VAL A 518
LEU A 517
LEU A 555
GLY A 387
LEU A 412
 None
 1.00A 2aylB-3u4aA:
undetectable		 2aylB-3u4aA:
21.70
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.
2AZX_A_TRPA601_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 3u4a JMB19063
(compost
metagenome) 		5 / 12 THR A 521
GLY A 522
GLY A 487
THR A 399
GLU A 484
 None
 1.34A 2azxA-3u4aA:
undetectable		 2azxA-3u4aA:
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.
2AZX_B_TRPB603_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 3u4a JMB19063
(compost
metagenome) 		5 / 12 THR A 521
GLY A 522
GLY A 487
THR A 399
GLU A 484
 None
 1.34A 2azxB-3u4aA:
undetectable		 2azxB-3u4aA:
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.
2B25_B_SAMB602_0
(HYPOTHETICAL PROTEIN)		 3u4a JMB19063
(compost
metagenome) 		5 / 12 THR A 244
GLY A 287
GLY A 238
ASP A 316
ILE A 315
 None
 1.15A 2b25B-3u4aA:
undetectable		 2b25B-3u4aA:
18.50
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.
2HS1_A_017A201_1
(HIV-1 PROTEASE)		 3u4a JMB19063
(compost
metagenome) 		5 / 12 GLY A 715
ASP A 664
ILE A 719
ILE A 662
ILE A 733
 CA  A 778 ( 3.7A)
CA  A 778 (-3.0A)
None
None
None
 1.02A 2hs1A-3u4aA:
undetectable		 2hs1A-3u4aA:
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.
2M2P_B_DHIB24_0
(INSULIN B CHAIN)		 3u4a JMB19063
(compost
metagenome) 		3 / 3 TYR A 652
GLY A 654
PHE A 619
 None
 0.69A 2m2pB-3u4aA:
undetectable		 2m2pB-3u4aA:
4.94
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.
2OKC_A_SAMA500_0
(TYPE I RESTRICTION
ENZYME STYSJI M
PROTEIN)		 3u4a JMB19063
(compost
metagenome) 		6 / 12 ILE A 124
GLY A  52
GLY A  82
VAL A  50
PRO A  78
PHE A 332
 None
 1.39A 2okcA-3u4aA:
undetectable		 2okcA-3u4aA:
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.
2QHF_A_ACTA509_0
(CHORISMATE SYNTHASE)		 3u4a JMB19063
(compost
metagenome) 		3 / 3 ARG A 492
GLN A 501
PRO A 498
 None
 0.87A 2qhfA-3u4aA:
undetectable		 2qhfA-3u4aA:
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.
2QQD_B_AG2B671_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE (EC
4.1.1.19) (PVLARGDC))		 3u4a JMB19063
(compost
metagenome) 		4 / 8 ARG A 248
LEU A  23
ASP A 289
GLY A 256
 None
 0.87A 2qqdB-3u4aA:
undetectable
2qqdC-3u4aA:
undetectable		 2qqdB-3u4aA:
8.80
2qqdC-3u4aA:
11.24
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.
2XRH_A_NIOA200_1
(PROTEIN HP0721)		 3u4a JMB19063
(compost
metagenome) 		4 / 7 GLY A  52
ILE A  77
GLN A  66
LEU A  80
 None
 1.02A 2xrhA-3u4aA:
undetectable		 2xrhA-3u4aA:
10.62
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.
2Y00_A_Y00A601_1
(BETA-1 ADRENERGIC
RECEPTOR)		 3u4a JMB19063
(compost
metagenome) 		5 / 12 LEU A  25
VAL A 293
ASP A  84
VAL A  85
ASN A  55
 None
None
BGC  A 776 (-2.8A)
None
BGC  A 776 ( 4.2A)
 1.42A 2y00A-3u4aA:
undetectable		 2y00A-3u4aA:
17.10
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.
2Y7H_B_SAMB530_0
(TYPE I RESTRICTION
ENZYME ECOKI M
PROTEIN)		 3u4a JMB19063
(compost
metagenome) 		6 / 12 ILE A 124
GLY A  52
GLY A  82
LEU A  10
PRO A  78
PHE A 332
 None
 1.37A 2y7hB-3u4aA:
undetectable		 2y7hB-3u4aA:
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.
2Y7H_C_SAMC530_0
(TYPE I RESTRICTION
ENZYME ECOKI M
PROTEIN)		 3u4a JMB19063
(compost
metagenome) 		6 / 12 ILE A 124
GLY A  52
GLY A  82
LEU A  10
PRO A  78
PHE A 332
 None
 1.36A 2y7hC-3u4aA:
undetectable		 2y7hC-3u4aA:
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.
3AOC_C_ERYC3402_1
(ACRIFLAVINE
RESISTANCE PROTEIN B)		 3u4a JMB19063
(compost
metagenome) 		3 / 3 THR A 620
SER A 562
LYS A 564
 None
 1.19A 3aocC-3u4aA:
undetectable		 3aocC-3u4aA:
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.
3AY0_B_ADNB402_1
(UNCHARACTERIZED
PROTEIN MJ0883)		 3u4a JMB19063
(compost
metagenome) 		5 / 10 GLY A 294
ASP A 291
ASN A  24
ASP A 289
VAL A 288
 None
 1.28A 3ay0B-3u4aA:
undetectable		 3ay0B-3u4aA:
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.
3BJW_G_SVRG506_3
(PHOSPHOLIPASE A2)		 3u4a JMB19063
(compost
metagenome) 		3 / 3 PRO A 672
PHE A 613
LYS A 674
 None
 1.17A 3bjwG-3u4aA:
undetectable		 3bjwG-3u4aA:
10.82
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.
3EEY_A_SAMA300_0
(PUTATIVE RRNA
METHYLASE)		 3u4a JMB19063
(compost
metagenome) 		5 / 12 GLY A 141
ASP A 137
ILE A  95
GLY A  98
THR A 521
 None
 0.99A 3eeyA-3u4aA:
undetectable		 3eeyA-3u4aA:
14.19
Potential target for repurposing, i.e. matched protein structure has less than 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)		 3u4a JMB19063
(compost
metagenome) 		5 / 12 GLY A 141
ASP A 137
ILE A  95
GLY A  98
THR A 521
 None
 1.02A 3eeyE-3u4aA:
undetectable		 3eeyE-3u4aA:
14.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IB1_A_IMNA701_1
(LACTOTRANSFERRIN)		 3u4a JMB19063
(compost
metagenome) 		4 / 4 PRO A 235
THR A 237
GLY A 296
THR A 299
 None
 1.09A 3ib1A-3u4aA:
undetectable		 3ib1A-3u4aA:
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.
3MDR_B_GJZB506_1
(CHOLESTEROL
24-HYDROXYLASE)		 3u4a JMB19063
(compost
metagenome) 		4 / 6 PHE A  93
ILE A 114
ALA A 115
ALA A 403
 None
 0.84A 3mdrB-3u4aA:
undetectable		 3mdrB-3u4aA:
20.95
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.
3N8W_A_FLPA701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 3u4a JMB19063
(compost
metagenome) 		5 / 12 VAL A 518
LEU A 517
LEU A 555
GLY A 387
LEU A 412
 None
 0.98A 3n8wA-3u4aA:
undetectable		 3n8wA-3u4aA:
21.70
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.
3PGH_D_FLPD701_1
(CYCLOOXYGENASE-2)		 3u4a JMB19063
(compost
metagenome) 		5 / 12 VAL A 518
LEU A 517
LEU A 555
GLY A 387
LEU A 412
 None
 1.02A 3pghD-3u4aA:
undetectable		 3pghD-3u4aA:
20.84
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.
4EMA_A_BRLA601_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 3u4a JMB19063
(compost
metagenome) 		5 / 12 GLY A 480
TYR A 428
LEU A 385
HIS A 430
LEU A 451
 None
 1.17A 4emaA-3u4aA:
undetectable		 4emaA-3u4aA:
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.
4J4V_B_SVRB301_1
(NUCLEOCAPSID PROTEIN)		 3u4a JMB19063
(compost
metagenome) 		5 / 10 GLY A 189
ASN A 229
ALA A 236
VAL A 198
MET A 200
 None
 1.42A 4j4vB-3u4aA:
0.0		 4j4vB-3u4aA:
17.02
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.
4J4V_D_SVRD301_1
(NUCLEOCAPSID PROTEIN)		 3u4a JMB19063
(compost
metagenome) 		5 / 11 GLY A 189
ASN A 229
ALA A 236
VAL A 198
MET A 200
 None
 1.40A 4j4vD-3u4aA:
undetectable
4j4vE-3u4aA:
undetectable		 4j4vD-3u4aA:
17.02
4j4vE-3u4aA:
17.02
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.
4J4V_E_SVRE301_1
(NUCLEOCAPSID PROTEIN)		 3u4a JMB19063
(compost
metagenome) 		5 / 10 GLY A 189
ASN A 229
ALA A 236
VAL A 198
MET A 200
 None
 1.46A 4j4vA-3u4aA:
0.0
4j4vE-3u4aA:
0.0		 4j4vA-3u4aA:
17.02
4j4vE-3u4aA:
17.02
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.
4K0B_B_SAMB504_1
(S-ADENOSYLMETHIONINE
SYNTHASE)		 3u4a JMB19063
(compost
metagenome) 		4 / 8 HIS A  87
PRO A  96
ALA A 115
TYR A 165
 None
 0.96A 4k0bB-3u4aA:
undetectable		 4k0bB-3u4aA:
20.31
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.
4L7I_B_SAMB501_1
(S-ADENOSYLMETHIONINE
SYNTHASE)		 3u4a JMB19063
(compost
metagenome) 		4 / 8 HIS A  87
PRO A  96
ALA A 115
TYR A 165
 None
 0.92A 4l7iB-3u4aA:
undetectable		 4l7iB-3u4aA:
20.31
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.
4RJD_B_TFPB204_1
(CALMODULIN)		 3u4a JMB19063
(compost
metagenome) 		4 / 8 GLY A 544
GLU A 546
GLU A 118
ALA A 403
 None
 0.73A 4rjdA-3u4aA:
undetectable
4rjdB-3u4aA:
undetectable		 4rjdA-3u4aA:
7.33
4rjdB-3u4aA:
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.
4RS0_A_IBPA706_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3u4a JMB19063
(compost
metagenome) 		5 / 9 VAL A 518
LEU A 517
LEU A 555
GLY A 387
LEU A 412
 None
 0.89A 4rs0A-3u4aA:
undetectable		 4rs0A-3u4aA:
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.
4XLD_A_BRLA502_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 3u4a JMB19063
(compost
metagenome) 		5 / 12 GLY A 480
TYR A 428
LEU A 385
HIS A 430
LEU A 451
 None
 1.23A 4xldA-3u4aA:
undetectable		 4xldA-3u4aA:
17.88
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.
4ZDY_A_1YNA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3u4a JMB19063
(compost
metagenome) 		5 / 12 GLY A 398
ILE A  62
GLY A  82
HIS A  87
THR A 399
 None
 1.05A 4zdyA-3u4aA:
undetectable		 4zdyA-3u4aA:
23.49
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.
4ZE2_A_1YNA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3u4a JMB19063
(compost
metagenome) 		5 / 12 GLY A 398
ILE A  62
GLY A  82
HIS A  87
THR A 399
 None
 1.14A 4ze2A-3u4aA:
undetectable		 4ze2A-3u4aA:
23.49
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.
5BS8_G_MFXG101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)		 3u4a JMB19063
(compost
metagenome) 		4 / 7 ASP A 194
ARG A 142
GLY A 487
GLU A 145
 None
BGC  A 776 (-2.9A)
None
None
 0.87A 5bs8A-3u4aA:
undetectable
5bs8C-3u4aA:
undetectable
5bs8D-3u4aA:
2.6		 5bs8A-3u4aA:
21.82
5bs8C-3u4aA:
21.82
5bs8D-3u4aA:
16.82
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.
5BTA_G_MFXG101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)		 3u4a JMB19063
(compost
metagenome) 		4 / 7 ASP A 194
ARG A 142
GLY A 487
GLU A 145
 None
BGC  A 776 (-2.9A)
None
None
 0.85A 5btaA-3u4aA:
undetectable
5btaC-3u4aA:
undetectable
5btaD-3u4aA:
2.6		 5btaA-3u4aA:
21.90
5btaC-3u4aA:
21.90
5btaD-3u4aA:
16.82
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.
5BTG_F_LFXF101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)		 3u4a JMB19063
(compost
metagenome) 		4 / 7 ASP A 194
ARG A 142
GLY A 487
GLU A 145
 None
BGC  A 776 (-2.9A)
None
None
 0.86A 5btgA-3u4aA:
undetectable
5btgC-3u4aA:
undetectable
5btgD-3u4aA:
2.6		 5btgA-3u4aA:
21.82
5btgC-3u4aA:
21.82
5btgD-3u4aA:
16.82
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.
5ESL_A_1YNA701_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3u4a JMB19063
(compost
metagenome) 		5 / 12 GLY A 398
ILE A  62
GLY A  82
HIS A  87
THR A 399
 None
 1.07A 5eslA-3u4aA:
undetectable		 5eslA-3u4aA:
23.49
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.
5GWX_A_SAMA301_1
(GLYCINE SARCOSINE
N-METHYLTRANSFERASE)		 3u4a JMB19063
(compost
metagenome) 		3 / 3 ARG A 671
ASN A 207
ASP A 150
 None
 0.78A 5gwxA-3u4aA:
undetectable		 5gwxA-3u4aA:
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.
5IKR_B_ID8B602_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3u4a JMB19063
(compost
metagenome) 		5 / 12 VAL A 518
LEU A 517
LEU A 555
GLY A 387
LEU A 412
 None
 1.08A 5ikrB-3u4aA:
undetectable		 5ikrB-3u4aA:
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.
5JVZ_A_FLPA601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3u4a JMB19063
(compost
metagenome) 		6 / 12 VAL A 518
LEU A 555
VAL A 386
GLY A 387
ALA A 390
LEU A 412
 None
 1.36A 5jvzA-3u4aA:
undetectable		 5jvzA-3u4aA:
21.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5M6G_A_SORA711_0
(BETA-GLUCOSIDASE)		 3u4a JMB19063
(compost
metagenome) 		10 / 12 ASP A  84
PHE A 128
ARG A 142
LYS A 181
HIS A 182
MET A 225
TYR A 262
MET A 292
TRP A 400
GLU A 488
 BGC  A 776 (-2.8A)
BGC  A 776 (-4.4A)
BGC  A 776 (-2.9A)
BGC  A 776 (-2.7A)
BGC  A 776 (-4.1A)
BGC  A 776 (-3.7A)
None
BGC  A 776 ( 3.8A)
None
BGC  A 776 ( 3.1A)
 0.48A 5m6gA-3u4aA:
38.1		 5m6gA-3u4aA:
30.16
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.
5N5D_A_SAMA306_0
(METHYLTRANSFERASE)		 3u4a JMB19063
(compost
metagenome) 		5 / 12 VAL A 540
GLY A 398
TRP A 400
GLU A 145
ALA A 483
 None
 1.15A 5n5dA-3u4aA:
undetectable		 5n5dA-3u4aA:
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.
5OG9_A_TESA503_1
(-)		 3u4a JMB19063
(compost
metagenome) 		5 / 9 LEU A 555
VAL A 374
LEU A 375
LEU A 385
PRO A 535
 None
 1.35A 5og9A-3u4aA:
undetectable		 5og9A-3u4aA:
21.33
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.
5X80_B_SALB203_1
(UNCHARACTERIZED
HTH-TYPE
TRANSCRIPTIONAL
REGULATOR RV2887)		 3u4a JMB19063
(compost
metagenome) 		4 / 6 PRO A 612
GLY A 614
TYR A 615
ARG A 726
 None
 0.83A 5x80A-3u4aA:
undetectable
5x80B-3u4aA:
undetectable		 5x80A-3u4aA:
12.96
5x80B-3u4aA:
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.
5X80_C_SALC201_1
(UNCHARACTERIZED
HTH-TYPE
TRANSCRIPTIONAL
REGULATOR RV2887)		 3u4a JMB19063
(compost
metagenome) 		4 / 7 VAL A 366
VAL A 657
GLY A 614
TYR A 615
 None
 0.97A 5x80C-3u4aA:
undetectable
5x80D-3u4aA:
undetectable		 5x80C-3u4aA:
12.96
5x80D-3u4aA:
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.
6D9K_F_ACTF802_0
(UNCHARACTERIZED
PROTEIN)		 3u4a JMB19063
(compost
metagenome) 		3 / 3 TYR A 213
ALA A 236
LEU A 185
 None
 0.75A 6d9kF-3u4aA:
2.8		 6d9kF-3u4aA:
22.34
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.
6ECE_C_DVAC3010_0
(VLM2
DODECADEPSIPEPTIDE)		 3u4a JMB19063
(compost
metagenome) 		3 / 3 ALA A 325
PHE A 170
GLN A 166
 None
 0.72A 6eceA-3u4aA:
3.6		 6eceA-3u4aA:
17.48