SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3b5q'

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.
1DHI_B_MTXB361_1
(DIHYDROFOLATE
REDUCTASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		5 / 11 ALA A  57
LEU A 334
ILE A 310
TYR A  34
THR A 328
 None
None
None
None
EDO  A 503 (-4.0A)
 1.07A 1dhiB-3b5qA:
undetectable		 1dhiB-3b5qA:
17.22
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.
1DZ9_A_CAMA503_0
(CYTOCHROME P450-CAM)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 8 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 0.96A 1dz9A-3b5qA:
undetectable		 1dz9A-3b5qA:
21.34
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.
1IWI_A_CAMA418_0
(CYTOCHROME P450-CAM)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 8 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 0.95A 1iwiA-3b5qA:
undetectable		 1iwiA-3b5qA:
21.30
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.
1J3J_A_CP6A609_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		5 / 10 ALA A  57
ILE A  21
ILE A 310
TYR A  34
THR A 328
 None
None
None
None
EDO  A 503 (-4.0A)
 1.12A 1j3jA-3b5qA:
undetectable		 1j3jA-3b5qA:
18.62
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.
1J3J_B_CP6B709_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		5 / 9 ALA A  57
ILE A  21
ILE A 310
TYR A  34
THR A 328
 None
None
None
None
EDO  A 503 (-4.0A)
 1.13A 1j3jB-3b5qA:
undetectable		 1j3jB-3b5qA:
18.62
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.
1RA3_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		5 / 12 ALA A  57
LEU A 334
ILE A 310
TYR A  34
THR A 328
 None
None
None
None
EDO  A 503 (-4.0A)
 1.09A 1ra3A-3b5qA:
undetectable		 1ra3A-3b5qA:
17.22
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.
1RB3_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		5 / 10 ALA A  57
LEU A 334
ILE A 310
TYR A  34
THR A 328
 None
None
None
None
EDO  A 503 (-4.0A)
 1.13A 1rb3A-3b5qA:
undetectable		 1rb3A-3b5qA:
17.22
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.
1RE7_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		5 / 12 ALA A  57
LEU A 334
ILE A 310
TYR A  34
THR A 328
 None
None
None
None
EDO  A 503 (-4.0A)
 1.08A 1re7A-3b5qA:
undetectable		 1re7A-3b5qA:
17.22
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.
1S9P_C_DESC500_1
(ESTROGEN-RELATED
RECEPTOR GAMMA)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		5 / 12 LEU A 335
LEU A 338
CYH A 339
LEU A 341
ALA A 342
 None
 1.07A 1s9pC-3b5qA:
undetectable		 1s9pC-3b5qA:
16.88
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.
1T85_A_CAMA422_0
(CYTOCHROME P450-CAM)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 0.97A 1t85A-3b5qA:
undetectable		 1t85A-3b5qA:
21.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1T87_A_CAMA1422_0
(CYTOCHROME P450-CAM)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 1.02A 1t87A-3b5qA:
undetectable		 1t87A-3b5qA:
21.34
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.
1XZ1_A_HLTA2001_1
(FERRITIN LIGHT CHAIN)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 4 LEU A 430
SER A 427
TYR A 426
LEU A 407
 None
None
EDO  A 513 ( 4.2A)
None
 1.25A 1xz1A-3b5qA:
undetectable		 1xz1A-3b5qA:
16.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1XZ3_A_ICFA201_1
(FERRITIN LIGHT CHAIN)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 4 LEU A 430
SER A 427
TYR A 426
LEU A 407
 None
None
EDO  A 513 ( 4.2A)
None
 1.25A 1xz3A-3b5qA:
undetectable		 1xz3A-3b5qA:
16.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1Y7I_A_SALA502_1
(SALICYLIC
ACID-BINDING PROTEIN
2)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		3 / 3 LEU A  63
HIS A 297
LYS A 296
 None
 0.81A 1y7iA-3b5qA:
undetectable		 1y7iA-3b5qA:
20.25
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.
1YRC_A_CAMA420_0
(CYTOCHROME P450-CAM)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 0.96A 1yrcA-3b5qA:
undetectable		 1yrcA-3b5qA:
21.34
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.
1YRD_A_CAMA420_0
(CYTOCHROME P450-CAM)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 1.00A 1yrdA-3b5qA:
undetectable		 1yrdA-3b5qA:
21.34
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.
1Z95_A_198A501_2
(ANDROGEN RECEPTOR)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 6 LEU A  71
LEU A 355
LEU A 338
ILE A 353
 None
EDO  A 503 (-4.4A)
None
EDO  A 503 (-3.7A)
 1.00A 1z95A-3b5qA:
undetectable		 1z95A-3b5qA:
18.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ZZ1_C_SHHC2652_1
(HISTONE
DEACETYLASE-LIKE
AMIDOHYDROLASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		5 / 12 LEU A 332
GLY A  60
HIS A  78
ASP A 446
TYR A 440
 None
 1.13A 1zz1C-3b5qA:
undetectable		 1zz1C-3b5qA:
24.34
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.
2B25_B_SAMB602_0
(HYPOTHETICAL PROTEIN)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		5 / 12 THR A 118
GLY A 122
VAL A 113
HIS A 129
ILE A 171
 None
 1.14A 2b25B-3b5qA:
undetectable		 2b25B-3b5qA:
21.27
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.
2B25_B_SAMB602_1
(HYPOTHETICAL PROTEIN)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		3 / 3 GLY A 116
GLU A 131
ASP A 175
 None
 0.70A 2b25B-3b5qA:
undetectable		 2b25B-3b5qA:
21.27
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.
2BL9_A_CP6A1240_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		5 / 12 ALA A  57
ILE A  21
ILE A 310
TYR A  34
THR A 328
 None
None
None
None
EDO  A 503 (-4.0A)
 1.18A 2bl9A-3b5qA:
undetectable		 2bl9A-3b5qA:
16.67
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.
2FEU_A_CAMA1420_0
(CYTOCHROME P450-CAM)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 6 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 0.92A 2feuA-3b5qA:
undetectable		 2feuA-3b5qA:
20.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2FEU_B_CAMB1421_0
(CYTOCHROME P450-CAM)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 0.96A 2feuB-3b5qA:
undetectable		 2feuB-3b5qA:
20.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HDN_J_TACJ5888_1
(ELONGATION FACTOR
EF-TU)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 6 SER A 123
ASP A 120
SER A  73
VAL A  98
 None
 1.18A 2hdnI-3b5qA:
undetectable
2hdnJ-3b5qA:
undetectable
2hdnL-3b5qA:
undetectable		 2hdnI-3b5qA:
6.51
2hdnJ-3b5qA:
21.22
2hdnL-3b5qA:
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.
2HDN_L_TACL6888_1
(ELONGATION FACTOR
EF-TU)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 6 SER A  73
VAL A  98
SER A 123
ASP A 120
 None
 1.29A 2hdnJ-3b5qA:
undetectable
2hdnK-3b5qA:
undetectable
2hdnL-3b5qA:
undetectable		 2hdnJ-3b5qA:
21.22
2hdnK-3b5qA:
6.51
2hdnL-3b5qA:
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.
2X2I_B_QPSB1050_1
(ALPHA-1,4-GLUCAN
LYASE ISOZYME 1)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		5 / 12 ASP A 151
LEU A 150
ASP A  24
HIS A 119
HIS A 129
 None
EDO  A 506 ( 4.8A)
None
None
None
 1.49A 2x2iB-3b5qA:
undetectable		 2x2iB-3b5qA:
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.
2ZUH_A_CAMA422_0
(CAMPHOR
5-MONOOXYGENASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 6 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 1.04A 2zuhA-3b5qA:
undetectable		 2zuhA-3b5qA:
21.81
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.
2ZUI_A_CAMA422_0
(CAMPHOR
5-MONOOXYGENASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 6 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 0.98A 2zuiA-3b5qA:
undetectable		 2zuiA-3b5qA:
21.30
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.
2ZWT_A_CAMA422_0
(CAMPHOR
5-MONOOXYGENASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 1.00A 2zwtA-3b5qA:
undetectable		 2zwtA-3b5qA:
21.30
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.
2ZWU_A_CAMA422_0
(CAMPHOR
5-MONOOXYGENASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 0.97A 2zwuA-3b5qA:
undetectable		 2zwuA-3b5qA:
21.30
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.
3FWF_A_CAMA420_0
(CAMPHOR
5-MONOOXYGENASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 0.97A 3fwfA-3b5qA:
undetectable		 3fwfA-3b5qA:
20.60
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.
3FWF_B_CAMB420_0
(CAMPHOR
5-MONOOXYGENASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 0.96A 3fwfB-3b5qA:
undetectable		 3fwfB-3b5qA:
20.60
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.
3FWI_A_CAMA420_0
(CAMPHOR
5-MONOOXYGENASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 0.96A 3fwiA-3b5qA:
undetectable		 3fwiA-3b5qA:
20.60
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.
3FWJ_A_CAMA420_0
(CAMPHOR
5-MONOOXYGENASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 0.99A 3fwjA-3b5qA:
undetectable		 3fwjA-3b5qA:
20.60
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.
3ITA_D_AICD501_1
(D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE
DACC)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		3 / 3 PRO A 169
PHE A 105
ALA A 342
 PEG  A 516 (-4.6A)
None
None
 0.67A 3itaD-3b5qA:
undetectable		 3itaD-3b5qA:
20.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3L63_A_CAMA440_0
(CAMPHOR
5-MONOOXYGENASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 0.97A 3l63A-3b5qA:
undetectable		 3l63A-3b5qA:
21.34
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.
3QGT_A_CP6A609_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		5 / 10 ALA A  57
ILE A  21
ILE A 310
TYR A  34
THR A 328
 None
None
None
None
EDO  A 503 (-4.0A)
 1.16A 3qgtA-3b5qA:
undetectable		 3qgtA-3b5qA:
21.17
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.
3QGT_B_CP6B609_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		5 / 10 ALA A  57
ILE A  21
ILE A 310
TYR A  34
THR A 328
 None
None
None
None
EDO  A 503 (-4.0A)
 1.14A 3qgtB-3b5qA:
undetectable		 3qgtB-3b5qA:
21.17
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.
3QL3_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		5 / 12 ALA A  57
LEU A 334
ILE A 310
TYR A  34
THR A 328
 None
None
None
None
EDO  A 503 (-4.0A)
 1.15A 3ql3A-3b5qA:
undetectable		 3ql3A-3b5qA:
17.22
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.
3S3M_A_DLUA398_1
(PFV INTEGRASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 8 GLY A 315
PRO A 357
GLN A 364
GLU A 362
 None
None
EDO  A 503 ( 4.6A)
None
 0.93A 3s3mA-3b5qA:
undetectable		 3s3mA-3b5qA:
21.85
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.
3WRH_A_CAMA503_0
(CAMPHOR
5-MONOOXYGENASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 0.98A 3wrhA-3b5qA:
undetectable		 3wrhA-3b5qA:
20.94
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.
3WRJ_A_CAMA503_0
(CAMPHOR
5-MONOOXYGENASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 0.96A 3wrjA-3b5qA:
undetectable		 3wrjA-3b5qA:
20.94
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.
3WRL_A_CAMA503_0
(CAMPHOR
5-MONOOXYGENASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 0.99A 3wrlA-3b5qA:
undetectable		 3wrlA-3b5qA:
20.94
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.
3WRL_E_CAME503_0
(CAMPHOR
5-MONOOXYGENASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 0.95A 3wrlE-3b5qA:
undetectable		 3wrlE-3b5qA:
20.94
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.
3WRM_A_CAMA503_0
(CAMPHOR
5-MONOOXYGENASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 0.96A 3wrmA-3b5qA:
undetectable		 3wrmA-3b5qA:
20.94
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.
3WRM_F_CAMF503_0
(CAMPHOR
5-MONOOXYGENASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 0.96A 3wrmF-3b5qA:
undetectable		 3wrmF-3b5qA:
20.94
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.
4A97_A_ZPCA1318_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 ILE A 217
GLU A 406
TYR A 301
VAL A  59
 EDO  A 507 ( 4.8A)
None
None
None
 1.07A 4a97A-3b5qA:
undetectable		 4a97A-3b5qA:
20.88
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.
4EYR_B_RITB301_1
(HIV-1 PROTEASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 ASP A  24
VAL A 256
ILE A  20
THR A  41
 None
 0.96A 4eyrA-3b5qA:
undetectable		 4eyrA-3b5qA:
12.35
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.
4L4A_A_CAMA502_0
(CAMPHOR
5-MONOOXYGENASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 8 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 1.00A 4l4aA-3b5qA:
undetectable		 4l4aA-3b5qA:
21.30
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.
4L4G_A_CAMA503_0
(CAMPHOR
5-MONOOXYGENASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 1.05A 4l4gA-3b5qA:
undetectable		 4l4gA-3b5qA:
21.50
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.
4MA8_C_Z80C301_1
(MAJOR PRION PROTEIN)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 5 LEU A 332
GLY A 352
LYS A 445
GLN A  79
 None
 1.10A 4ma8C-3b5qA:
undetectable		 4ma8C-3b5qA:
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.
4MBS_A_MRVA1101_2
(CHIMERA PROTEIN OF
C-C CHEMOKINE
RECEPTOR TYPE 5 AND
RUBREDOXIN)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 GLN A  36
THR A  37
THR A 295
MET A 293
 EDO  A 514 (-4.2A)
EDO  A 508 (-3.1A)
None
None
 1.08A 4mbsA-3b5qA:
undetectable		 4mbsA-3b5qA:
18.36
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.
4OKW_A_198A1001_2
(ANDROGEN RECEPTOR)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 LEU A  71
LEU A 355
LEU A 338
ILE A 353
 None
EDO  A 503 (-4.4A)
None
EDO  A 503 (-3.7A)
 0.97A 4okwA-3b5qA:
undetectable		 4okwA-3b5qA:
19.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4OLT_B_GCSB304_1
(CHITOSANASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 5 TYR A 399
THR A 397
HIS A 291
TYR A 466
 None
 1.40A 4oltB-3b5qA:
undetectable		 4oltB-3b5qA:
20.17
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.
4P66_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		5 / 11 ALA A  57
LEU A 334
ILE A 310
TYR A  34
THR A 328
 None
None
None
None
EDO  A 503 (-4.0A)
 1.10A 4p66A-3b5qA:
undetectable		 4p66A-3b5qA:
16.39
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.
4QWP_A_GCSA303_1
(CHITOSANASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 6 TYR A 399
THR A 397
HIS A 291
TYR A 466
 None
 1.42A 4qwpA-3b5qA:
undetectable		 4qwpA-3b5qA:
20.17
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.
5CDN_G_EVPG2101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT
B,DNA GYRASE SUBUNIT
B)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 6 SER A 373
GLU A 374
GLY A 287
ASP A 286
 None
 0.64A 5cdnA-3b5qA:
undetectable
5cdnB-3b5qA:
undetectable		 5cdnA-3b5qA:
22.46
5cdnB-3b5qA:
16.84
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.
5CDN_N_EVPN2101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT
B,DNA GYRASE SUBUNIT
B)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 6 SER A 373
GLU A 374
GLY A 287
ASP A 286
 None
 0.65A 5cdnR-3b5qA:
undetectable
5cdnS-3b5qA:
undetectable		 5cdnR-3b5qA:
22.46
5cdnS-3b5qA:
16.84
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.
5GQB_A_GCSA605_1
(CHITINASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		3 / 3 TRP A 375
ILE A 224
SER A 227
 None
 0.81A 5gqbA-3b5qA:
undetectable		 5gqbA-3b5qA:
21.94
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.
5JI0_A_9CRA501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		5 / 11 PHE A 311
LEU A 355
ALA A 356
VAL A 307
LEU A  71
 None
EDO  A 503 (-4.4A)
None
None
None
 1.24A 5ji0A-3b5qA:
undetectable		 5ji0A-3b5qA:
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.
5OEX_A_CUA602_0
(THIOCYANATE
DEHYDROGENASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		3 / 3 LYS A 296
HIS A 284
HIS A  25
 None
 1.03A 5oexA-3b5qA:
undetectable		 5oexA-3b5qA:
21.56
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.
5OEX_B_CUB602_0
(THIOCYANATE
DEHYDROGENASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		3 / 3 LYS A 296
HIS A 284
HIS A  25
 None
 1.01A 5oexB-3b5qA:
undetectable		 5oexB-3b5qA:
21.56
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.
5OEX_C_CUC603_0
(THIOCYANATE
DEHYDROGENASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		3 / 3 LYS A 296
HIS A 284
HIS A  25
 None
 1.03A 5oexC-3b5qA:
undetectable		 5oexC-3b5qA:
21.56
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.
5OEX_D_CUD603_0
(THIOCYANATE
DEHYDROGENASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		3 / 3 LYS A 296
HIS A 284
HIS A  25
 None
 1.00A 5oexD-3b5qA:
undetectable		 5oexD-3b5qA:
21.56
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.
5UIH_A_8CVA201_1
(DIHYDROFOLATE
REDUCTASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		5 / 8 ALA A  57
LEU A 334
ILE A 310
TYR A  34
THR A 328
 None
None
None
None
EDO  A 503 (-4.0A)
 1.14A 5uihA-3b5qA:
undetectable		 5uihA-3b5qA:
11.04
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.
5WK9_A_CAMA503_0
(CAMPHOR
5-MONOOXYGENASE)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 7 THR A 276
LEU A 267
VAL A 263
VAL A 113
 None
 1.04A 5wk9A-3b5qA:
undetectable		 5wk9A-3b5qA:
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.
6DWD_D_GLYD713_0
(DEOXYNUCLEOSIDE
TRIPHOSPHATE
TRIPHOSPHOHYDROLASE
SAMHD1)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		3 / 3 ARG A  83
HIS A  78
ARG A 387
 None
 1.04A 6dwdD-3b5qA:
undetectable		 6dwdD-3b5qA:
23.01
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.
6DWD_D_GLYD713_0
(DEOXYNUCLEOSIDE
TRIPHOSPHATE
TRIPHOSPHOHYDROLASE
SAMHD1)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		3 / 3 ARG A 434
HIS A 398
ARG A 449
 None
 1.15A 6dwdD-3b5qA:
undetectable		 6dwdD-3b5qA:
23.01
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.
6FGD_A_ACTA806_0
(GEPHYRIN)		 3b5q PUTATIVE SULFATASE
YIDJ
(Bacteroides
thetaiotaomicron) 		4 / 4 MET A 304
GLY A 285
HIS A  25
GLY A 287
 None
 1.18A 6fgdA-3b5qA:
undetectable		 6fgdA-3b5qA:
22.09