SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2bwa'

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.
1D4Y_A_TPVA501_2
(PROTEIN (HIV-1
PROTEASE))		 2bwa ENDOGLUCANASE
(Rhodothermus
marinus) 		4 / 8 LEU A   5
GLY A 205
VAL A  36
ILE A  34
 None
 0.66A 1d4yB-2bwaA:
undetectable		 1d4yB-2bwaA:
18.64
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.
1KT6_A_RTLA184_0
(PLASMA
RETINOL-BINDING
PROTEIN)		 2bwa ENDOGLUCANASE
(Rhodothermus
marinus) 		5 / 11 LEU A  84
ALA A 123
VAL A 224
TYR A 198
LEU A  77
 None
 1.29A 1kt6A-2bwaA:
undetectable		 1kt6A-2bwaA:
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.
1KT7_A_RTLA184_0
(PLASMA
RETINOL-BINDING
PROTEIN)		 2bwa ENDOGLUCANASE
(Rhodothermus
marinus) 		5 / 11 LEU A  84
ALA A 123
VAL A 224
TYR A 198
LEU A  77
 None
 1.30A 1kt7A-2bwaA:
undetectable		 1kt7A-2bwaA:
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.
2AOJ_C_FRDC305_2
(POL POLYPROTEIN
PEPTIDE INHIBITOR)		 2bwa ENDOGLUCANASE
(Rhodothermus
marinus) 		4 / 7 LEU A   5
GLY A 205
VAL A  36
ILE A  34
 None
 0.74A 2aojB-2bwaA:
undetectable		 2aojB-2bwaA:
19.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2COJ_A_GBNA420_1
(BRANCHED CHAIN
AMINOTRANSFERASE 1,
CYTOSOLIC)		 2bwa ENDOGLUCANASE
(Rhodothermus
marinus) 		5 / 11 TYR A  19
GLY A  41
THR A  40
ALA A  15
VAL A 222
 None
 1.41A 2cojA-2bwaA:
undetectable
2cojB-2bwaA:
undetectable		 2cojA-2bwaA:
20.56
2cojB-2bwaA:
20.56
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.
3IA4_D_MTXD164_2
(DIHYDROFOLATE
REDUCTASE)		 2bwa ENDOGLUCANASE
(Rhodothermus
marinus) 		3 / 3 ARG A  88
ILE A 127
THR A 169
 None
None
GOL  A1230 (-3.8A)
 0.71A 3ia4D-2bwaA:
undetectable		 3ia4D-2bwaA:
21.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4EJJ_C_NCTC501_1
(CYTOCHROME P450 2A6)		 2bwa ENDOGLUCANASE
(Rhodothermus
marinus) 		4 / 5 PHE A  43
PHE A 206
ILE A  45
GLY A 214
 None
 1.00A 4ejjC-2bwaA:
undetectable		 4ejjC-2bwaA:
17.30
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.
5KR2_A_ROCA101_2
(PROTEASE PR5-SQV)		 2bwa ENDOGLUCANASE
(Rhodothermus
marinus) 		5 / 11 LEU A   5
ASN A  23
GLY A 205
VAL A  36
ILE A  34
 None
 1.06A 5kr2B-2bwaA:
undetectable		 5kr2B-2bwaA:
17.73
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.
5KR2_C_ROCC101_2
(PROTEASE PR5-SQV)		 2bwa ENDOGLUCANASE
(Rhodothermus
marinus) 		5 / 9 LEU A   5
ASN A  23
GLY A 205
VAL A  36
ILE A  34
 None
 1.08A 5kr2D-2bwaA:
undetectable		 5kr2D-2bwaA:
17.73
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.
5NZX_A_9F2A1102_1
(DNA CROSS-LINK
REPAIR 1A PROTEIN)		 2bwa ENDOGLUCANASE
(Rhodothermus
marinus) 		4 / 8 ASN A  42
PHE A  43
THR A  89
ILE A  62
 None
 0.96A 5nzxA-2bwaA:
undetectable		 5nzxA-2bwaA:
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.
5NZY_A_CE3A1102_1
(DNA CROSS-LINK
REPAIR 1A PROTEIN)		 2bwa ENDOGLUCANASE
(Rhodothermus
marinus) 		4 / 7 ASN A  42
PHE A  43
THR A  89
ILE A  62
 None
 0.84A 5nzyA-2bwaA:
undetectable		 5nzyA-2bwaA:
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.
6DWD_B_GLYB709_0
(DEOXYNUCLEOSIDE
TRIPHOSPHATE
TRIPHOSPHOHYDROLASE
SAMHD1)		 2bwa ENDOGLUCANASE
(Rhodothermus
marinus) 		4 / 5 GLY A  53
ASN A  52
ASP A  51
ARG A 100
 None
None
None
GOL  A1006 (-2.7A)
 1.37A 6dwdB-2bwaA:
undetectable
6dwdD-2bwaA:
undetectable		 6dwdB-2bwaA:
16.82
6dwdD-2bwaA:
16.82