SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5wgx'

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.
1CLA_A_CLMA221_0
(TYPE III
CHLORAMPHENICOL
ACETYLTRANSFERASE)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 10 ALA A 506
ALA A 423
LEU A 395
VAL A 389
ILE A 397
 None
 1.22A 1claA-5wgxA:
undetectable		 1claA-5wgxA:
14.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GTB_A_PZQA901_0
(GLUTATHIONE
S-TRANSFERASE)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		3 / 3 GLN A 488
TYR A 474
ARG A 475
 None
 0.67A 1gtbA-5wgxA:
undetectable		 1gtbA-5wgxA:
16.31
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.
1HPV_B_478B200_2
(HIV-1 PROTEASE)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 9 ASP A 205
VAL A 204
GLY A  46
ILE A  47
ILE A 397
 None
None
FAD  A 701 (-3.4A)
FAD  A 701 (-4.9A)
None
 1.11A 1hpvB-5wgxA:
undetectable		 1hpvB-5wgxA:
10.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HTT_B_HISB450_0
(HISTIDYL-TRNA
SYNTHETASE)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 12 GLU A  81
LEU A 369
TYR A 370
GLY A 233
TYR A  77
 None
 1.26A 1httB-5wgxA:
3.3		 1httB-5wgxA:
22.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UWJ_B_BAXB1723_2
(B-RAF PROTO-ONCOGENE
SERINE/THREONINE-PRO
TEIN KINASE)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		3 / 3 ILE A  69
ASP A 169
PHE A 170
 None
None
FAD  A 701 (-4.5A)
 0.57A 1uwjB-5wgxA:
undetectable		 1uwjB-5wgxA:
19.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2A1M_A_CAMA1422_0
(CYTOCHROME P450-CAM)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		4 / 7 THR A 404
VAL A 414
GLY A 415
THR A 418
 None
 0.72A 2a1mA-5wgxA:
undetectable		 2a1mA-5wgxA:
22.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2A1M_B_CAMB2422_0
(CYTOCHROME P450-CAM)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		4 / 8 THR A 404
VAL A 414
GLY A 415
THR A 418
 None
 0.74A 2a1mB-5wgxA:
undetectable		 2a1mB-5wgxA:
22.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2AVS_B_MK1B902_3
(POL POLYPROTEIN)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 12 GLY A 233
ILE A 267
VAL A 264
PRO A 406
ILE A  79
 None
None
None
FAD  A 701 (-4.0A)
FAD  A 701 (-4.0A)
 1.03A 2avsB-5wgxA:
undetectable		 2avsB-5wgxA:
11.92
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.
2BM9_A_SAMA301_1
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		3 / 3 LYS A 557
ASP A 571
ASN A 582
 None
 1.06A 2bm9A-5wgxA:
3.1		 2bm9A-5wgxA:
16.12
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.
2KCE_B_D16B568_1
(THYMIDYLATE SYNTHASE)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 12 SER A 147
TRP A 272
GLY A 106
PHE A 105
ALA A 237
 None
 1.24A 2kceB-5wgxA:
undetectable		 2kceB-5wgxA:
17.37
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.
2O4P_A_TPVA300_2
(PROTEASE)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 9 LEU A  64
VAL A 160
GLY A  49
ILE A 397
ILE A  66
 None
 0.88A 2o4pB-5wgxA:
undetectable		 2o4pB-5wgxA:
10.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OPX_A_DXCA1002_0
(ALDEHYDE
DEHYDROGENASE A)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		3 / 3 GLY A 251
ARG A 268
TYR A 249
 None
 0.86A 2opxA-5wgxA:
2.5		 2opxA-5wgxA:
23.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QHF_A_ACTA507_0
(CHORISMATE SYNTHASE)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		3 / 3 LEU A  34
ASN A  25
ARG A 166
 None
 0.87A 2qhfA-5wgxA:
0.3		 2qhfA-5wgxA:
20.47
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.
2RCT_A_RTLA140_1
(RETINOL-BINDING
PROTEIN II, CELLULAR)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		3 / 3 GLN A 605
THR A  89
TRP A 645
 None
None
MB5  A 718 (-4.3A)
 0.94A 2rctA-5wgxA:
undetectable		 2rctA-5wgxA:
11.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2TOD_A_DMOA700_1
(PROTEIN (ORNITHINE
DECARBOXYLASE))		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		4 / 6 TYR A 114
CYH A 128
ASP A 126
ASP A 247
 None
CD  A 705 (-2.6A)
None
None
 1.23A 2todA-5wgxA:
undetectable
2todB-5wgxA:
undetectable		 2todA-5wgxA:
21.12
2todB-5wgxA:
21.12
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.
3B0W_B_DGXB1_1
(NUCLEAR RECEPTOR
ROR-GAMMA)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 12 LEU A 382
ALA A 230
VAL A 324
PHE A 259
LEU A 116
 FAD  A 701 ( 4.7A)
FAD  A 701 (-3.6A)
None
None
None
 1.35A 3b0wB-5wgxA:
undetectable		 3b0wB-5wgxA:
16.57
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.
3EKP_B_478B200_2
(PROTEASE)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 10 LEU A  64
VAL A 160
GLY A  49
ILE A 397
ILE A  66
 None
 0.96A 3ekpB-5wgxA:
undetectable		 3ekpB-5wgxA:
10.02
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.
3EKP_C_478C200_1
(PROTEASE)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 10 LEU A  64
VAL A 160
GLY A  49
ILE A 397
ILE A  66
 None
 0.98A 3ekpC-5wgxA:
undetectable		 3ekpC-5wgxA:
10.02
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.
3EKQ_A_ROCA100_2
(PROTEASE)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 9 LEU A  64
VAL A 160
GLY A  49
ILE A 397
ILE A  66
 None
 0.92A 3ekqB-5wgxA:
undetectable		 3ekqB-5wgxA:
9.84
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.
3I5U_A_SAMA401_1
(O-METHYLTRANSFERASE)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		4 / 4 ASP A 578
SER A 576
PHE A 577
SER A 558
 None
 1.44A 3i5uA-5wgxA:
2.3		 3i5uA-5wgxA:
19.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NDT_A_ROCA101_2
(PROTEASE)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		3 / 3 ARG A  74
VAL A 162
THR A 152
 None
 0.80A 3ndtA-5wgxA:
undetectable		 3ndtA-5wgxA:
11.84
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.
3NUJ_B_478B401_2
(PROTEASE)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 9 LEU A  64
VAL A 160
GLY A  49
ILE A 397
ILE A  66
 None
 0.93A 3nujB-5wgxA:
undetectable		 3nujB-5wgxA:
12.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OY4_B_017B200_1
(HIV-1 PROTEASE)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 11 LEU A  64
VAL A 160
GLY A  49
ILE A 397
ILE A  66
 None
 0.94A 3oy4A-5wgxA:
undetectable		 3oy4A-5wgxA:
10.02
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.
3Q5S_A_ACHA1289_0
(MULTIDRUG-EFFLUX
TRANSPORTER 1
REGULATOR)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		4 / 6 VAL A 204
ASN A 182
TYR A  52
ILE A 429
 None
 1.22A 3q5sA-5wgxA:
undetectable		 3q5sA-5wgxA:
16.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3QEL_D_QELD2_1
(NMDA GLUTAMATE
RECEPTOR SUBUNIT
GLUTAMATE [NMDA]
RECEPTOR SUBUNIT
EPSILON-2)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		4 / 5 TYR A 593
THR A 594
ARG A 607
LEU A 135
 None
None
SO4  A 712 (-2.8A)
None
 1.41A 3qelC-5wgxA:
2.3		 3qelC-5wgxA:
19.03
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.
3VAS_B_ADNB401_2
(PUTATIVE ADENOSINE
KINASE)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		4 / 5 LEU A 497
ALA A 509
THR A  89
PHE A 505
 None
 1.32A 3vasB-5wgxA:
3.6		 3vasB-5wgxA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DQH_B_017B101_1
(WILD-TYPE HIV-1
PROTEASE DIMER)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 11 LEU A  64
VAL A 160
GLY A  49
ILE A 397
ILE A  66
 None
 0.99A 4dqhA-5wgxA:
undetectable		 4dqhA-5wgxA:
10.88
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.
4H1N_A_CGEA505_1
(CYTOCHROME P450 2B4)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 11 ILE A 397
LEU A 449
ALA A 422
ILE A  66
VAL A  42
 None
 0.79A 4h1nA-5wgxA:
undetectable		 4h1nA-5wgxA:
22.72
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.
4H1N_A_CGEA505_1
(CYTOCHROME P450 2B4)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 11 LEU A 449
ALA A 422
ALA A 423
ILE A  66
VAL A  42
 None
 1.09A 4h1nA-5wgxA:
undetectable		 4h1nA-5wgxA:
22.72
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.
4KSZ_A_CYSA620_0
(LACTOPEROXIDASE)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		3 / 3 ARG A 325
GLU A 261
PHE A 349
 None
 0.87A 4kszA-5wgxA:
undetectable		 4kszA-5wgxA:
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.
4LNW_A_T3A502_1
(THYROID HORMONE
RECEPTOR ALPHA)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		4 / 8 ASP A 292
MET A 281
VAL A 284
THR A 285
 None
 0.96A 4lnwA-5wgxA:
undetectable		 4lnwA-5wgxA:
18.06
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.
4MMC_A_29JA604_1
(TRANSPORTER)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		4 / 7 ILE A 429
LEU A 449
ASP A 453
THR A 418
 None
 0.94A 4mmcA-5wgxA:
undetectable		 4mmcA-5wgxA:
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.
4NJU_A_TPVA500_2
(PROTEASE)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 10 LEU A  64
VAL A 160
GLY A  49
ILE A 397
ILE A  66
 None
 0.89A 4njuB-5wgxA:
undetectable		 4njuB-5wgxA:
10.88
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.
4NJU_C_TPVC500_2
(PROTEASE)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 10 LEU A  64
VAL A 160
GLY A  49
ILE A 397
ILE A  66
 None
 0.88A 4njuD-5wgxA:
undetectable		 4njuD-5wgxA:
10.88
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.
4QYN_B_RTLB201_0
(RETINOL-BINDING
PROTEIN 2)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 12 ILE A  79
GLN A 141
THR A 254
TRP A 514
LEU A  84
 FAD  A 701 (-4.0A)
None
CL  A 717 ( 4.1A)
None
None
 1.23A 4qynB-5wgxA:
undetectable		 4qynB-5wgxA:
12.41
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.
4QZT_A_RTLA201_0
(RETINOL-BINDING
PROTEIN 2)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 12 ILE A  79
GLN A 141
THR A 254
TRP A 514
LEU A  84
 FAD  A 701 (-4.0A)
None
CL  A 717 ( 4.1A)
None
None
 1.22A 4qztA-5wgxA:
2.6		 4qztA-5wgxA:
12.41
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.
4YVG_A_SAMA301_0
(TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 12 GLY A 181
GLU A  37
ILE A 445
GLY A 179
GLY A 178
 None
 1.01A 4yvgA-5wgxA:
undetectable		 4yvgA-5wgxA:
18.04
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.
5E3I_A_HISA502_0
(HISTIDINE--TRNA
LIGASE)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 12 GLU A  81
LEU A 369
TYR A 370
GLY A 233
TYR A  77
 None
 1.21A 5e3iA-5wgxA:
3.3		 5e3iA-5wgxA:
21.45
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.
5EWJ_B_QELB503_1
(NMDA GLUTAMATE
RECEPTOR SUBUNIT
GLUTAMATE RECEPTOR
IONOTROPIC, NMDA 2B)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 11 TYR A 593
THR A 594
ARG A 607
LEU A 135
ALA A 138
 None
None
SO4  A 712 (-2.8A)
None
None
 1.26A 5ewjA-5wgxA:
3.8
5ewjB-5wgxA:
undetectable		 5ewjA-5wgxA:
19.41
5ewjB-5wgxA:
20.39
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.
5EWJ_D_QELD503_1
(NMDA GLUTAMATE
RECEPTOR SUBUNIT
GLUTAMATE RECEPTOR
IONOTROPIC, NMDA 2B)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 12 TYR A 593
THR A 594
ARG A 607
LEU A 135
ALA A 138
 None
None
SO4  A 712 (-2.8A)
None
None
 1.32A 5ewjC-5wgxA:
4.1
5ewjD-5wgxA:
undetectable		 5ewjC-5wgxA:
19.41
5ewjD-5wgxA:
20.39
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.
5IWU_A_ACTA402_0
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		4 / 6 VAL A 500
TYR A 508
MET A 416
ILE A  86
 None
 1.29A 5iwuA-5wgxA:
undetectable		 5iwuA-5wgxA:
18.32
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.
5O45_B_CCSB13_0
(PHE-MEA-9KK-SAR-ASP-
VAL-MEA-TYR-SAR-TRP-
TYR-LEU-CCS-GLY-NH2
PROGRAMMED CELL
DEATH 1 LIGAND 1)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 9 TYR A 114
ASN A 255
VAL A 266
PHE A 246
LEU A 248
 None
 1.36A 5o45A-5wgxA:
undetectable
5o45B-5wgxA:
undetectable		 5o45A-5wgxA:
11.63
5o45B-5wgxA:
2.02
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.
5O4Y_D_CCSD14_0
(PHE-MAA-ASN-PRO-HIS-
LEU-SER-TRP-SER-TRP-
9KK-9KK-ARG-CCS-GLY-
NH2
PROGRAMMED CELL
DEATH 1 LIGAND 1)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 12 LEU A 459
SER A 386
GLY A 402
GLY A 398
THR A 418
 None
None
None
FAD  A 701 ( 3.8A)
None
 0.96A 5o4yD-5wgxA:
undetectable
5o4yE-5wgxA:
undetectable		 5o4yD-5wgxA:
2.98
5o4yE-5wgxA:
11.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Y2T_A_8LXA501_0
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 12 LEU A 497
GLY A 492
GLN A 488
LEU A 574
LEU A 407
 None
 1.26A 5y2tA-5wgxA:
undetectable		 5y2tA-5wgxA:
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.
6BTX_A_EDTA503_0
(SOLUTE CARRIER
FAMILY 39
(IRON-REGULATED
TRANSPORTER))		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		4 / 7 TRP A 265
SER A  82
SER A 409
GLY A 411
 None
CL  A 717 (-3.9A)
CL  A 717 ( 3.0A)
FAD  A 701 (-3.2A)
 0.94A 6btxA-5wgxA:
undetectable		 6btxA-5wgxA:
22.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6DJZ_B_GMJB301_0
(SIGMA NON-OPIOID
INTRACELLULAR
RECEPTOR 1)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 12 TRP A  90
ILE A  47
THR A 418
THR A  83
LEU A 140
 None
FAD  A 701 (-4.9A)
None
None
None
 1.40A 6djzB-5wgxA:
undetectable		 6djzB-5wgxA:
16.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6DRX_A_H8GA1201_0
(5HT2B RECEPTOR, BRIL
CHIMERA)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 12 VAL A 266
SER A 319
THR A 318
PHE A 359
PHE A 346
 None
 0.96A 6drxA-5wgxA:
undetectable		 6drxA-5wgxA:
19.44
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.
6DRZ_A_H8JA1206_0
(5HT2B RECEPTOR, BRIL
CHIMERA)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 12 VAL A 266
SER A 319
THR A 318
PHE A 359
PHE A 346
 None
 1.07A 6drzA-5wgxA:
undetectable		 6drzA-5wgxA:
19.44
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.
6G9B_B_IXXB705_1
(ENVELOPE
GLYCOPROTEIN,ENVELOP
E GLYCOPROTEIN
ENVELOPE
GLYCOPROTEIN)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		4 / 5 ARG A  12
ALA A 278
GLN A 156
ILE A 153
 None
 1.39A 6g9bA-5wgxA:
undetectable
6g9bB-5wgxA:
undetectable		 6g9bA-5wgxA:
8.52
6g9bB-5wgxA:
8.17
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.
6GNG_A_QPSA601_2
(-)		 5wgx FLAVIN-DEPENDENT
HALOGENASE
(Malbranchea
aurantiaca) 		5 / 12 GLY A  49
PRO A 270
VAL A 162
GLU A  70
GLY A  44
 None
None
None
FAD  A 701 (-2.7A)
FAD  A 701 (-3.5A)
 1.40A 6gngA-5wgxA:
3.4		 6gngA-5wgxA:
20.98