SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'CXS'


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.
1AV2_D_DVAD8_0
(GRAMICIDIN A)		 3tfz CYCLASE
(Streptomyces
sp.
R1128) 		3 / 3 VAL A  53
VAL A  37
TRP A  62
 None
None
CXS  A 171 (-4.4A)
 0.69A 1av2C-3tfzA:
undetectable
1av2D-3tfzA:
undetectable		 1av2C-3tfzA:
11.00
1av2D-3tfzA:
11.00
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.
1DZ8_A_CAMA503_0
(CYTOCHROME P450-CAM)		 3tfz CYCLASE
(Streptomyces
sp.
R1128) 		5 / 9 THR A  34
VAL A  24
GLY A  26
VAL A 150
ASP A 146
 None
None
None
None
CXS  A 171 (-4.7A)
 1.36A 1dz8A-3tfzA:
undetectable		 1dz8A-3tfzA:
20.45
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.
1DZ8_B_CAMB502_0
(CYTOCHROME P450-CAM)		 3tfz CYCLASE
(Streptomyces
sp.
R1128) 		5 / 9 THR A  34
VAL A  24
GLY A  26
VAL A 150
ASP A 146
 None
None
None
None
CXS  A 171 (-4.7A)
 1.33A 1dz8B-3tfzA:
undetectable		 1dz8B-3tfzA:
20.45
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.
1DZ9_B_CAMB502_0
(CYTOCHROME P450-CAM)		 3tfz CYCLASE
(Streptomyces
sp.
R1128) 		5 / 9 THR A  34
VAL A  24
GLY A  26
VAL A 150
ASP A 146
 None
None
None
None
CXS  A 171 (-4.7A)
 1.33A 1dz9B-3tfzA:
undetectable		 1dz9B-3tfzA:
20.45
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.
1ERE_C_ESTC600_1
(ESTROGEN RECEPTOR)		 3l2h PUTATIVE SUGAR
PHOSPHATE ISOMERASE
(Acidithiobacillu
s
ferrooxidans) 		5 / 9 GLU A  12
LEU A   8
LEU A   7
ARG A   4
LEU A  49
 None
None
None
None
CXS  A 164 (-4.4A)
 1.49A 1ereC-3l2hA:
undetectable		 1ereC-3l2hA:
23.05
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.
1ERE_F_ESTF600_1
(ESTROGEN RECEPTOR)		 3l2h PUTATIVE SUGAR
PHOSPHATE ISOMERASE
(Acidithiobacillu
s
ferrooxidans) 		5 / 8 GLU A  12
LEU A   8
LEU A   7
ARG A   4
LEU A  49
 None
None
None
None
CXS  A 164 (-4.4A)
 1.48A 1ereF-3l2hA:
undetectable		 1ereF-3l2hA:
23.05
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.
1HK2_A_T44A3002_1
(SERUM ALBUMIN)		 3hjv MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE
(Vibrio
cholerae) 		4 / 8 GLN A  68
LEU A  72
LEU A  49
TYR A  47
 CL  A 331 ( 4.2A)
None
None
CXS  A 325 (-4.2A)
 1.16A 1hk2A-3hjvA:
undetectable		 1hk2A-3hjvA:
19.83
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UW6_A_NCTA1208_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		4 / 8 TYR A  88
TRP A 142
THR A 143
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.7A)
 0.45A 1uw6A-2bj0A:
24.8
1uw6B-2bj0A:
25.8		 1uw6A-2bj0A:
43.00
1uw6B-2bj0A:
43.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UW6_B_NCTB1206_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		5 / 9 TYR A  88
TRP A 142
THR A 143
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.44A 1uw6B-2bj0A:
25.8
1uw6C-2bj0A:
25.6		 1uw6B-2bj0A:
43.00
1uw6C-2bj0A:
43.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UW6_D_NCTD1208_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		4 / 8 TYR A  88
TRP A 142
THR A 143
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.7A)
 0.48A 1uw6D-2bj0A:
25.0
1uw6E-2bj0A:
25.2		 1uw6D-2bj0A:
43.00
1uw6E-2bj0A:
43.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UW6_F_NCTF1208_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		5 / 10 TYR A  88
TRP A 142
THR A 143
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.45A 1uw6F-2bj0A:
25.1
1uw6G-2bj0A:
25.3		 1uw6F-2bj0A:
43.00
1uw6G-2bj0A:
43.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UW6_G_NCTG1206_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		4 / 8 TYR A  88
TRP A 142
THR A 143
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.7A)
 0.47A 1uw6G-2bj0A:
25.3
1uw6H-2bj0A:
25.4		 1uw6G-2bj0A:
43.00
1uw6H-2bj0A:
43.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UW6_H_NCTH1206_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		5 / 10 TYR A  88
TRP A 142
THR A 143
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.44A 1uw6H-2bj0A:
25.4
1uw6I-2bj0A:
25.4		 1uw6H-2bj0A:
43.00
1uw6I-2bj0A:
43.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UW6_J_NCTJ1206_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		5 / 9 TYR A  88
TRP A 142
THR A 143
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.41A 1uw6F-2bj0A:
25.1
1uw6J-2bj0A:
25.5		 1uw6F-2bj0A:
43.00
1uw6J-2bj0A:
43.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UW6_M_NCTM1208_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		5 / 10 TYR A  88
TRP A 142
THR A 143
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.47A 1uw6M-2bj0A:
25.3
1uw6N-2bj0A:
25.7		 1uw6M-2bj0A:
43.00
1uw6N-2bj0A:
43.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UW6_N_NCTN1208_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		5 / 10 TYR A  88
TRP A 142
THR A 143
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.41A 1uw6N-2bj0A:
25.7
1uw6O-2bj0A:
25.4		 1uw6N-2bj0A:
43.00
1uw6O-2bj0A:
43.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UW6_O_NCTO1206_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		5 / 9 TYR A  88
TRP A 142
THR A 143
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.44A 1uw6K-2bj0A:
24.8
1uw6O-2bj0A:
25.4		 1uw6K-2bj0A:
43.00
1uw6O-2bj0A:
43.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UW6_P_NCTP1206_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		4 / 8 TYR A  88
TRP A 142
THR A 143
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.7A)
 0.44A 1uw6P-2bj0A:
25.1
1uw6Q-2bj0A:
25.5		 1uw6P-2bj0A:
43.00
1uw6Q-2bj0A:
43.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UW6_Q_NCTQ1206_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		5 / 10 TYR A  88
TRP A 142
THR A 143
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.44A 1uw6Q-2bj0A:
25.5
1uw6R-2bj0A:
25.2		 1uw6Q-2bj0A:
43.00
1uw6R-2bj0A:
43.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UW6_S_NCTS1206_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		5 / 10 TYR A  88
TRP A 142
THR A 143
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.46A 1uw6S-2bj0A:
25.4
1uw6T-2bj0A:
25.2		 1uw6S-2bj0A:
43.00
1uw6T-2bj0A:
43.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UW6_T_NCTT1208_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		4 / 8 TYR A  88
TRP A 142
THR A 143
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.7A)
 0.44A 1uw6P-2bj0A:
25.1
1uw6T-2bj0A:
25.2		 1uw6P-2bj0A:
43.00
1uw6T-2bj0A:
43.00
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.
1W5U_D_DVAD8_0
(GRAMICIDIN D)		 3tfz CYCLASE
(Streptomyces
sp.
R1128) 		3 / 3 VAL A  53
VAL A  37
TRP A  62
 None
None
CXS  A 171 (-4.4A)
 0.71A 1w5uC-3tfzA:
undetectable
1w5uD-3tfzA:
undetectable		 1w5uC-3tfzA:
11.00
1w5uD-3tfzA:
11.00
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.
1XQL_A_4AXA605_1
(ALANINE RACEMASE)		 3m4f ENDO-1,4-BETA-XYLANA
SE
(Acidomyces
acidophilus) 		4 / 8 PHE A 150
TYR A  93
TYR A  35
ARG A 138
 None
None
CXS  A 206 (-3.9A)
CXS  A 206 (-3.9A)
 0.98A 1xqlA-3m4fA:
undetectable
1xqlB-3m4fA:
undetectable		 1xqlA-3m4fA:
18.46
1xqlB-3m4fA:
18.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1XQL_B_4AXB505_1
(ALANINE RACEMASE)		 3m4f ENDO-1,4-BETA-XYLANA
SE
(Acidomyces
acidophilus) 		4 / 8 TYR A  35
ARG A 138
PHE A 150
TYR A  93
 CXS  A 206 (-3.9A)
CXS  A 206 (-3.9A)
None
None
 0.99A 1xqlA-3m4fA:
undetectable
1xqlB-3m4fA:
undetectable		 1xqlA-3m4fA:
18.46
1xqlB-3m4fA:
18.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2A1O_B_CAMB2422_0
(CYTOCHROME P450-CAM)		 3tfz CYCLASE
(Streptomyces
sp.
R1128) 		5 / 9 THR A  34
VAL A  24
GLY A  26
VAL A 150
ASP A 146
 None
None
None
None
CXS  A 171 (-4.7A)
 1.36A 2a1oB-3tfzA:
undetectable		 2a1oB-3tfzA:
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.
2BTE_D_LEUD1893_0
(AMINOACYL-TRNA
SYNTHETASE)		 3m4f ENDO-1,4-BETA-XYLANA
SE
(Acidomyces
acidophilus) 		4 / 8 ASP A 127
SER A 126
TYR A 131
HIS A 171
 CXS  A 207 (-3.6A)
CXS  A 207 (-3.4A)
None
None
 1.35A 2bteD-3m4fA:
undetectable		 2bteD-3m4fA:
11.39
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.
2BXE_B_1FLB2002_1
(SERUM ALBUMIN)		 2x1m METHIONYL-TRNA
SYNTHETASE
(Mycolicibacteriu
m
smegmatis) 		5 / 11 ARG A 174
ALA A 276
ALA A 114
SER A 169
LEU A 168
 CXS  A 602 (-4.2A)
None
None
None
None
 1.06A 2bxeB-2x1mA:
undetectable		 2bxeB-2x1mA:
23.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2CP4_A_CAMA416_0
(CYTOCHROME P450-CAM)		 3tfz CYCLASE
(Streptomyces
sp.
R1128) 		5 / 10 THR A  34
VAL A  24
GLY A  26
VAL A 150
ASP A 146
 None
None
None
None
CXS  A 171 (-4.7A)
 1.32A 2cp4A-3tfzA:
undetectable		 2cp4A-3tfzA:
18.91
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.
2IZQ_A_DVAA8_0
(GRAMICIDIN D)		 3tfz CYCLASE
(Streptomyces
sp.
R1128) 		3 / 3 VAL A  37
TRP A  62
VAL A  53
 None
CXS  A 171 (-4.4A)
None
 0.85A 2izqA-3tfzA:
undetectable
2izqB-3tfzA:
undetectable		 2izqA-3tfzA:
11.00
2izqB-3tfzA:
11.00
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.
2KUH_A_HLTA150_1
(CALMODULIN)		 4jpq UNCHARACTERIZED
PROTEIN
(Bacteroides
uniformis) 		4 / 6 LEU A 143
MET A 189
LEU A 187
GLU A 121
 None
None
None
CXS  A 301 ( 4.7A)
 1.13A 2kuhA-4jpqA:
undetectable		 2kuhA-4jpqA:
13.89
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.
2KUH_A_HLTA150_1
(CALMODULIN)		 4jpq UNCHARACTERIZED
PROTEIN
(Bacteroides
uniformis) 		4 / 6 LEU A 143
MET A 189
LEU A 187
GLU A 136
 None
None
None
CXS  A 301 ( 4.8A)
 1.13A 2kuhA-4jpqA:
undetectable		 2kuhA-4jpqA:
13.89
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.
2RK8_A_PPFA3969_1
(PHOSPHOENOLPYRUVATE
CARBOXYKINASE,
CYTOSOLIC [GTP])		 4nho PROBABLE
ATP-DEPENDENT RNA
HELICASE DDX23
(Homo
sapiens) 		4 / 8 SER A 378
ASP A 376
ARG A 757
ALA A 632
 None
CXS  A 908 (-3.9A)
None
None
 1.29A 2rk8A-4nhoA:
undetectable		 2rk8A-4nhoA:
21.23
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2WNC_A_TKTA300_1
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		6 / 10 TYR A  88
TRP A 142
TYR A 184
CSS A 186
CSS A 187
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 (-4.6A)
CXS  A1204 (-3.4A)
CXS  A1204 (-3.6A)
CXS  A1204 (-4.7A)
 0.80A 2wncA-2bj0A:
22.5
2wncE-2bj0A:
18.8		 2wncA-2bj0A:
31.49
2wncE-2bj0A:
31.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2WNC_A_TKTA300_1
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		5 / 10 TYR A  88
TRP A 142
TYR A 184
CSS A 186
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 (-4.6A)
CXS  A1204 (-3.4A)
CXS  A1204 (-4.7A)
 1.21A 2wncA-2bj0A:
22.5
2wncE-2bj0A:
18.8		 2wncA-2bj0A:
31.49
2wncE-2bj0A:
31.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2XZ5_A_ACHA1210_0
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		4 / 6 TYR A  88
TRP A 142
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.55A 2xz5A-2bj0A:
24.8
2xz5B-2bj0A:
24.7		 2xz5A-2bj0A:
31.30
2xz5B-2bj0A:
31.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2XZ5_B_ACHB1210_0
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		4 / 7 TYR A  88
TRP A 142
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.55A 2xz5B-2bj0A:
24.7
2xz5E-2bj0A:
24.6		 2xz5B-2bj0A:
31.30
2xz5E-2bj0A:
31.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2XZ5_C_ACHC1210_0
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		4 / 8 TYR A  88
TRP A 142
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.56A 2xz5A-2bj0A:
24.8
2xz5C-2bj0A:
24.6		 2xz5A-2bj0A:
31.30
2xz5C-2bj0A:
31.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2XZ5_D_ACHD1210_0
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		4 / 8 TYR A  88
TRP A 142
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.56A 2xz5C-2bj0A:
24.6
2xz5D-2bj0A:
24.7		 2xz5C-2bj0A:
31.30
2xz5D-2bj0A:
31.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2XZ5_E_ACHE1210_0
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		4 / 7 TYR A  88
TRP A 142
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.55A 2xz5D-2bj0A:
24.7
2xz5E-2bj0A:
24.6		 2xz5D-2bj0A:
31.30
2xz5E-2bj0A:
31.30
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.
3ERD_A_DESA600_1
(ESTROGEN RECEPTOR
ALPHA)		 3l2h PUTATIVE SUGAR
PHOSPHATE ISOMERASE
(Acidithiobacillu
s
ferrooxidans) 		6 / 12 GLU A  12
LEU A  36
LEU A   8
LEU A   7
ARG A   4
LEU A  49
 None
None
None
None
None
CXS  A 164 (-4.4A)
 1.48A 3erdA-3l2hA:
undetectable		 3erdA-3l2hA:
23.48
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.
3HM1_A_J3ZA2_1
(ESTROGEN RECEPTOR)		 3l2h PUTATIVE SUGAR
PHOSPHATE ISOMERASE
(Acidithiobacillu
s
ferrooxidans) 		6 / 12 GLU A  12
LEU A  36
LEU A   8
LEU A   7
ARG A   4
LEU A  49
 None
None
None
None
None
CXS  A 164 (-4.4A)
 1.49A 3hm1A-3l2hA:
undetectable		 3hm1A-3l2hA:
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.
3L8L_B_DVAB8_0
(GRAMICIDIN D)		 3tfz CYCLASE
(Streptomyces
sp.
R1128) 		3 / 3 VAL A  53
VAL A  37
TRP A  62
 None
None
CXS  A 171 (-4.4A)
 0.76A 3l8lA-3tfzA:
undetectable
3l8lB-3tfzA:
undetectable		 3l8lA-3tfzA:
11.00
3l8lB-3tfzA:
11.00
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.
3L8L_D_DVAD8_0
(GRAMICIDIN D)		 3tfz CYCLASE
(Streptomyces
sp.
R1128) 		3 / 3 VAL A  53
VAL A  37
TRP A  62
 None
None
CXS  A 171 (-4.4A)
 0.68A 3l8lC-3tfzA:
undetectable
3l8lD-3tfzA:
undetectable		 3l8lC-3tfzA:
11.00
3l8lD-3tfzA:
11.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3LS4_H_TCIH220_2
(HEAVY CHAIN OF
ANTIBODY FAB
FRAGMENT
LIGHT CHAIN OF
ANTIBODY FAB
FRAGMENT)		 5xcx VL-SARAH(S37C)
CHIMERA
(Homo
sapiens;
Mus
musculus) 		5 / 5 TYR B  36
GLN B  89
ILE B  94
LEU B  96
PHE B  98
 None
None
CXS  A 204 ( 4.9A)
None
None
 0.31A 3ls4L-5xcxB:
23.2		 3ls4L-5xcxB:
50.91
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.
3OWX_B_XRAB233_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 4xfe TRAP DICARBOXYLATE
TRANSPORTER SUBUNIT
DCTP
(Pseudomonas
putida) 		5 / 11 VAL A 100
GLY A 124
GLY A 121
TYR A 328
ILE A 118
 None
None
None
CXS  A 402 (-3.0A)
None
 1.38A 3owxA-4xfeA:
undetectable
3owxB-4xfeA:
undetectable		 3owxA-4xfeA:
21.02
3owxB-4xfeA:
21.02
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.
3OXZ_A_0LIA1_2
(TYROSINE-PROTEIN
KINASE ABL1)		 2bk9 CG9734-PA
(Drosophila
melanogaster) 		5 / 9 LEU A 134
VAL A 101
ILE A 142
LEU A 114
VAL A 112
 CXS  A1155 ( 4.1A)
HEM  A1154 ( 3.8A)
None
None
None
 1.45A 3oxzA-2bk9A:
undetectable		 3oxzA-2bk9A:
19.86
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.
3ROZ_A_NCAA266_0
(APOLIPOPROTEIN
A-I-BINDING PROTEIN)		 3r2h BACTERIOFERRITIN
(Pseudomonas
aeruginosa) 		4 / 6 ASP A  74
ALA A  99
LEU A  14
THR A  13
 CXS  A 155 (-3.7A)
None
None
None
 1.09A 3rozA-3r2hA:
undetectable		 3rozA-3r2hA:
21.37
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.
3T3S_D_9PLD1_1
(CYTOCHROME P450 2A13)		 4mjf HYPOTHETICAL PROTEIN
(Bacteroides
vulgatus) 		4 / 8 PHE A 152
PHE A  64
PHE A  71
ALA A  72
 None
CXS  A 300 ( 4.9A)
None
EDO  A 307 ( 3.9A)
 0.72A 3t3sD-4mjfA:
undetectable		 3t3sD-4mjfA:
21.25
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.
3UUD_B_ESTB600_1
(ESTROGEN RECEPTOR)		 3l2h PUTATIVE SUGAR
PHOSPHATE ISOMERASE
(Acidithiobacillu
s
ferrooxidans) 		5 / 10 GLU A  12
LEU A   8
LEU A   7
ARG A   4
LEU A  49
 None
None
None
None
CXS  A 164 (-4.4A)
 1.46A 3uudB-3l2hA:
undetectable		 3uudB-3l2hA:
22.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3WIP_A_ACHA301_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		5 / 7 TYR A  88
TRP A 142
THR A 143
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.66A 3wipA-2bj0A:
25.1
3wipB-2bj0A:
24.6		 3wipA-2bj0A:
40.44
3wipB-2bj0A:
40.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3WIP_B_ACHB301_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		5 / 8 TYR A  88
TRP A 142
THR A 143
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.71A 3wipB-2bj0A:
24.6
3wipC-2bj0A:
25.2		 3wipB-2bj0A:
40.44
3wipC-2bj0A:
40.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3WIP_C_ACHC301_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		5 / 8 TYR A  88
TRP A 142
THR A 143
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.69A 3wipC-2bj0A:
25.2
3wipD-2bj0A:
25.2		 3wipC-2bj0A:
40.44
3wipD-2bj0A:
40.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3WIP_D_ACHD301_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		5 / 8 TYR A  88
TRP A 142
THR A 143
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.70A 3wipD-2bj0A:
25.2
3wipE-2bj0A:
25.1		 3wipD-2bj0A:
40.44
3wipE-2bj0A:
40.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3WIP_E_ACHE301_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		5 / 8 TYR A  88
TRP A 142
THR A 143
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.76A 3wipA-2bj0A:
25.1
3wipE-2bj0A:
25.1		 3wipA-2bj0A:
40.44
3wipE-2bj0A:
40.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3WIP_F_ACHF301_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		5 / 7 TYR A  88
TRP A 142
THR A 143
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.66A 3wipF-2bj0A:
24.5
3wipG-2bj0A:
25.9		 3wipF-2bj0A:
40.44
3wipG-2bj0A:
40.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3WIP_G_ACHG301_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		5 / 8 TYR A  88
TRP A 142
THR A 143
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.68A 3wipG-2bj0A:
25.9
3wipH-2bj0A:
24.8		 3wipG-2bj0A:
40.44
3wipH-2bj0A:
40.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3WIP_H_ACHH301_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		5 / 9 TYR A  88
TRP A 142
THR A 143
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.64A 3wipH-2bj0A:
24.8
3wipI-2bj0A:
25.4		 3wipH-2bj0A:
40.44
3wipI-2bj0A:
40.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3WIP_I_ACHI301_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		5 / 9 TYR A  88
TRP A 142
THR A 143
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.85A 3wipI-2bj0A:
25.4
3wipJ-2bj0A:
25.0		 3wipI-2bj0A:
40.44
3wipJ-2bj0A:
40.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3WIP_J_ACHJ301_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		5 / 8 TYR A  88
TRP A 142
THR A 143
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.66A 3wipF-2bj0A:
24.5
3wipJ-2bj0A:
25.0		 3wipF-2bj0A:
40.44
3wipJ-2bj0A:
40.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4AFT_D_QMRD301_1
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		4 / 8 TYR A  88
TRP A 142
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.32A 4aftD-2bj0A:
24.4
4aftE-2bj0A:
19.0		 4aftD-2bj0A:
31.30
4aftE-2bj0A:
31.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4BQT_C_C5EC301_0
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		4 / 8 TYR A  88
TRP A 142
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.34A 4bqtC-2bj0A:
24.5
4bqtD-2bj0A:
24.4		 4bqtC-2bj0A:
31.30
4bqtD-2bj0A:
31.30
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.
4EJG_A_NCTA501_1
(CYTOCHROME P450 2A13)		 4mjf HYPOTHETICAL PROTEIN
(Bacteroides
vulgatus) 		4 / 7 PHE A 152
PHE A  64
PHE A  71
ALA A  72
 None
CXS  A 300 ( 4.9A)
None
EDO  A 307 ( 3.9A)
 0.67A 4ejgA-4mjfA:
undetectable		 4ejgA-4mjfA:
21.25
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.
4KIC_B_SAMB401_1
(METHYLTRANSFERASE
MPPJ)		 4jpq UNCHARACTERIZED
PROTEIN
(Bacteroides
uniformis) 		3 / 3 ARG A 167
ASP A 117
ASP A 218
 None
None
CXS  A 301 ( 4.5A)
 0.87A 4kicB-4jpqA:
undetectable		 4kicB-4jpqA:
21.39
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.
4XRG_A_AG2A502_1
(HOMOSPERMIDINE
SYNTHASE)		 3m4f ENDO-1,4-BETA-XYLANA
SE
(Acidomyces
acidophilus) 		5 / 12 GLU A 192
VAL A 106
TYR A 104
TYR A  89
ASP A  60
 None
None
None
None
CXS  A 206 ( 4.4A)
 1.42A 4xrgA-3m4fA:
undetectable		 4xrgA-3m4fA:
19.26
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.
5DXE_B_ESTB1000_1
(ESTROGEN RECEPTOR)		 3l2h PUTATIVE SUGAR
PHOSPHATE ISOMERASE
(Acidithiobacillu
s
ferrooxidans) 		5 / 10 GLU A  12
LEU A   8
LEU A   7
ARG A   4
LEU A  49
 None
None
None
None
CXS  A 164 (-4.4A)
 1.48A 5dxeB-3l2hA:
undetectable		 5dxeB-3l2hA:
23.48
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.
5DXG_A_ESTA1000_1
(ESTROGEN RECEPTOR)		 3l2h PUTATIVE SUGAR
PHOSPHATE ISOMERASE
(Acidithiobacillu
s
ferrooxidans) 		5 / 9 GLU A  12
LEU A   8
LEU A   7
ARG A   4
LEU A  49
 None
None
None
None
CXS  A 164 (-4.4A)
 1.49A 5dxgA-3l2hA:
undetectable		 5dxgA-3l2hA:
23.48
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.
5HYR_A_ESTA601_1
(ESTROGEN RECEPTOR)		 3l2h PUTATIVE SUGAR
PHOSPHATE ISOMERASE
(Acidithiobacillu
s
ferrooxidans) 		5 / 10 GLU A  12
LEU A   8
LEU A   7
ARG A   4
LEU A  49
 None
None
None
None
CXS  A 164 (-4.4A)
 1.45A 5hyrA-3l2hA:
undetectable		 5hyrA-3l2hA:
22.96
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.
5HYR_B_ESTB601_1
(ESTROGEN RECEPTOR)		 3l2h PUTATIVE SUGAR
PHOSPHATE ISOMERASE
(Acidithiobacillu
s
ferrooxidans) 		5 / 11 GLU A  12
LEU A   8
LEU A   7
ARG A   4
LEU A  49
 None
None
None
None
CXS  A 164 (-4.4A)
 1.49A 5hyrB-3l2hA:
undetectable		 5hyrB-3l2hA:
22.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5JWA_A_ACTA609_0
(NADH DEHYDROGENASE,
PUTATIVE)		 5jwb TYPE II
NADH:UBIQUINONE
OXIDOREDUCTASE
(Plasmodium
falciparum) 		3 / 3 VAL A 481
SER A 497
TRP A 500
 None
CXS  A 614 ( 4.8A)
CXS  A 614 (-3.8A)
 0.12A 5jwaA-5jwbA:
56.9		 5jwaA-5jwbA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5JWA_A_ACTA610_0
(NADH DEHYDROGENASE,
PUTATIVE)		 5jwb TYPE II
NADH:UBIQUINONE
OXIDOREDUCTASE
(Plasmodium
falciparum) 		4 / 4 ASP A 221
LYS A 225
HIS A 479
ARG A 529
 CXS  A 614 (-3.7A)
CXS  A 614 (-2.4A)
CXS  A 614 (-3.6A)
CXS  A 614 (-2.3A)
 0.47A 5jwaA-5jwbA:
56.9		 5jwaA-5jwbA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5JWA_H_ACTH610_0
(NADH DEHYDROGENASE,
PUTATIVE)		 5jwb TYPE II
NADH:UBIQUINONE
OXIDOREDUCTASE
(Plasmodium
falciparum) 		4 / 4 ASP A 221
LYS A 225
HIS A 479
ARG A 529
 CXS  A 614 (-3.7A)
CXS  A 614 (-2.4A)
CXS  A 614 (-3.6A)
CXS  A 614 (-2.3A)
 0.57A 5jwaH-5jwbA:
56.9		 5jwaH-5jwbA:
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.
5KXI_A_NCTA402_1
(NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-4
NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
BETA-2)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		4 / 8 TYR A  88
TRP A 142
THR A 143
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.7A)
 0.75A 5kxiA-2bj0A:
22.6
5kxiB-2bj0A:
21.8		 5kxiA-2bj0A:
19.49
5kxiB-2bj0A:
17.82
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.
5KXI_D_NCTD402_1
(NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-4
NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
BETA-2)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		4 / 8 TYR A  88
TRP A 142
THR A 143
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.7A)
 0.76A 5kxiD-2bj0A:
22.4
5kxiE-2bj0A:
21.7		 5kxiD-2bj0A:
19.49
5kxiE-2bj0A:
17.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5TZO_A_7V7A202_1
(ENDO-1,4-BETA-XYLANA
SE A)		 3m4f ENDO-1,4-BETA-XYLANA
SE
(Acidomyces
acidophilus) 		5 / 12 VAL A  62
TRP A  95
TYR A 104
PRO A 142
TRP A 154
 None
None
None
CXS  A 206 ( 4.3A)
None
 0.81A 5tzoA-3m4fA:
26.8		 5tzoA-3m4fA:
39.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5TZO_C_7V7C201_1
(ENDO-1,4-BETA-XYLANA
SE A)		 3m4f ENDO-1,4-BETA-XYLANA
SE
(Acidomyces
acidophilus) 		5 / 12 VAL A  62
TRP A  95
TYR A 104
PRO A 142
TRP A 154
 None
None
None
CXS  A 206 ( 4.3A)
None
 0.83A 5tzoC-3m4fA:
26.7		 5tzoC-3m4fA:
39.15
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.
5V0V_A_8QPA612_1
(SERUM ALBUMIN)		 3tw5 TRANSGLUTAMINASE
ELICITOR
(Phytophthora
sojae) 		5 / 12 TYR A 468
LEU A 185
HIS A 368
LEU A 472
GLU A 404
 None
None
None
None
CXS  A   1 (-2.8A)
 1.15A 5v0vA-3tw5A:
undetectable		 5v0vA-3tw5A:
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.
6CDU_D_EY4D500_0
(CHIMERIC ALPHA1GABAA
RECEPTOR)		 5mtj MONOBODY MB(YES_1)
(Homo
sapiens) 		4 / 7 ILE B  70
VAL B  10
ALA B  13
THR B  14
 None
None
None
CXS  B 102 (-3.7A)
 0.95A 6cduC-5mtjB:
undetectable
6cduD-5mtjB:
2.0		 6cduC-5mtjB:
16.98
6cduD-5mtjB:
16.98
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.
6CNJ_D_NCTD402_1
(NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-4
NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
BETA-2)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		4 / 8 TYR A  88
TRP A 142
THR A 143
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.7A)
 0.76A 6cnjD-2bj0A:
21.6
6cnjE-2bj0A:
10.7		 6cnjD-2bj0A:
17.44
6cnjE-2bj0A:
15.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6CNK_A_NCTA405_1
(NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-4)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		4 / 6 TYR A  88
TRP A 142
THR A 143
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.7A)
 0.70A 6cnkA-2bj0A:
21.5
6cnkB-2bj0A:
15.1		 6cnkA-2bj0A:
17.44
6cnkB-2bj0A:
17.44
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.
6CNK_B_NCTB402_1
(NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-4
NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
BETA-2)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		5 / 7 TYR A  88
TRP A 142
CSS A 186
CSS A 187
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 (-3.4A)
CXS  A1204 (-3.6A)
CXS  A1204 (-4.7A)
 0.68A 6cnkB-2bj0A:
15.1
6cnkC-2bj0A:
20.7		 6cnkB-2bj0A:
17.44
6cnkC-2bj0A:
15.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6CNK_B_NCTB402_1
(NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-4
NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
BETA-2)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		4 / 7 TYR A  88
TRP A 142
CSS A 187
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 (-3.6A)
CXS  A1204 (-4.7A)
 1.28A 6cnkB-2bj0A:
15.1
6cnkC-2bj0A:
20.7		 6cnkB-2bj0A:
17.44
6cnkC-2bj0A:
15.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6CNK_D_NCTD401_1
(NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-4
NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
BETA-2)		 2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN
(Bulinus
truncatus) 		5 / 9 TYR A  88
TRP A 142
THR A 143
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.84A 6cnkD-2bj0A:
21.3
6cnkE-2bj0A:
9.9		 6cnkD-2bj0A:
17.44
6cnkE-2bj0A:
15.08
Potential target for repurposing, i.e. matched protein structure has less than 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_A_GMJA301_1
(SIGMA NON-OPIOID
INTRACELLULAR
RECEPTOR 1)		 3tfz CYCLASE
(Streptomyces
sp.
R1128) 		4 / 6 SER A  64
GLN A  47
GLU A  38
THR A  61
 CXS  A 171 (-2.9A)
None
None
None
 1.28A 6djzA-3tfzA:
undetectable		 6djzA-3tfzA:
23.87
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.
6DYO_A_LDPA901_0
(EBONY)		 3r2h BACTERIOFERRITIN
(Pseudomonas
aeruginosa) 		4 / 5 GLU A  18
VAL A  96
LEU A  92
HIS A  77
 NA  A 156 (-2.8A)
None
CXS  A 155 ( 4.1A)
CXS  A 155 (-4.1A)
 1.38A 6dyoA-3r2hA:
undetectable		 6dyoA-3r2hA:
19.33