SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3ois'

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.
1STF_E_CCSE25_0
(PAPAIN
STEFIN B (CYSTATIN
B))		 3ois CYSTEINE PROTEASE
(Xylella
fastidiosa) 		6 / 10 GLN A  72
GLY A  76
SER A  77
HIS A 237
ALA A 238
GLY A  34
 None
 0.69A 1stfE-3oisA:
21.8
1stfI-3oisA:
0.5		 1stfE-3oisA:
24.24
1stfI-3oisA:
16.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2WEK_B_DIFB1373_1
(ZINC-BINDING ALCOHOL
DEHYDROGENASE
DOMAIN-CONTAINING
PROTEIN 2)		 3ois CYSTEINE PROTEASE
(Xylella
fastidiosa) 		4 / 8 SER A 219
VAL A 210
PHE A 267
ASN A 255
 None
 1.21A 2wekB-3oisA:
undetectable		 2wekB-3oisA:
22.87
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.
3AI8_A_HNQA255_1
(CATHEPSIN B)		 3ois CYSTEINE PROTEASE
(Xylella
fastidiosa) 		4 / 7 GLN A  72
GLY A  76
HIS A 237
TRP A 257
 None
 0.54A 3ai8A-3oisA:
22.2		 3ai8A-3oisA:
24.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3S3O_A_DLUA399_1
(PFV INTEGRASE)		 3ois CYSTEINE PROTEASE
(Xylella
fastidiosa) 		4 / 7 ASP A 192
TYR A 271
GLN A 189
ARG A 249
 None
 1.26A 3s3oA-3oisA:
undetectable		 3s3oA-3oisA:
20.48
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.
3TJ7_A_ACTA609_0
(GBAA_1210 PROTEIN)		 3ois CYSTEINE PROTEASE
(Xylella
fastidiosa) 		3 / 3 LYS A 113
VAL A 118
HIS A 117
 None
 1.16A 3tj7A-3oisA:
undetectable		 3tj7A-3oisA:
20.36
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.
3UR0_B_SVRB516_1
(RNA-DEPENDENT RNA
POLYMERASE)		 3ois CYSTEINE PROTEASE
(Xylella
fastidiosa) 		4 / 7 PRO A 159
GLY A 161
ALA A 162
ASP A 148
 None
 0.67A 3ur0B-3oisA:
undetectable		 3ur0B-3oisA:
21.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4G3R_B_CAMB502_0
(CAMPHOR
5-MONOOXYGENASE)		 3ois CYSTEINE PROTEASE
(Xylella
fastidiosa) 		4 / 6 PHE A 251
TYR A 244
LEU A  57
VAL A 187
 None
 1.13A 4g3rB-3oisA:
undetectable		 4g3rB-3oisA:
20.05
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.
5HFJ_E_SAME301_0
(ADENINE SPECIFIC DNA
METHYLTRANSFERASE
(DPNA))		 3ois CYSTEINE PROTEASE
(Xylella
fastidiosa) 		5 / 12 ALA A  82
ASP A  71
GLY A  32
SER A  31
TYR A  33
 None
 1.27A 5hfjE-3oisA:
undetectable		 5hfjE-3oisA:
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.
5VLM_G_CVIG301_0
(REGULATORY PROTEIN
TETR)		 3ois CYSTEINE PROTEASE
(Xylella
fastidiosa) 		5 / 12 ALA A  85
GLU A 111
LEU A 133
ILE A 181
ASP A 128
 None
 1.26A 5vlmG-3oisA:
undetectable		 5vlmG-3oisA:
21.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6DRX_A_H8GA1201_0
(5HT2B RECEPTOR, BRIL
CHIMERA)		 3ois CYSTEINE PROTEASE
(Xylella
fastidiosa) 		5 / 12 SER A  77
THR A  79
ALA A 238
ASN A 255
TYR A 146
 None
 1.48A 6drxA-3oisA:
undetectable		 6drxA-3oisA:
19.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6MN5_A_LLLA301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 3ois CYSTEINE PROTEASE
(Xylella
fastidiosa) 		4 / 6 ASP A  44
TYR A 184
ASP A 128
GLU A 115
 UDP  A 292 (-3.7A)
UDP  A 292 (-3.2A)
None
None
 1.22A 6mn5A-3oisA:
undetectable		 6mn5A-3oisA:
13.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6MN5_B_LLLB301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 3ois CYSTEINE PROTEASE
(Xylella
fastidiosa) 		4 / 7 ASP A  44
TYR A 184
ASP A 128
GLU A 115
 UDP  A 292 (-3.7A)
UDP  A 292 (-3.2A)
None
None
 1.10A 6mn5B-3oisA:
undetectable		 6mn5B-3oisA:
13.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6MN5_C_LLLC301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 3ois CYSTEINE PROTEASE
(Xylella
fastidiosa) 		4 / 6 ASP A  44
TYR A 184
ASP A 128
GLU A 115
 UDP  A 292 (-3.7A)
UDP  A 292 (-3.2A)
None
None
 1.03A 6mn5C-3oisA:
undetectable		 6mn5C-3oisA:
13.19