SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '6bdt'

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.
1MAA_D_DMED999_1
(ACETYLCHOLINESTERASE)		 6bdt CALPAIN-3
(Homo
sapiens) 		4 / 8 GLY A 221
GLU A 226
TYR A  89
HIS A 213
 None
 0.95A 1maaD-6bdtA:
undetectable		 1maaD-6bdtA:
8.14
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.
1SBR_A_VIBA502_1
(YKOF)		 6bdt CALPAIN-3
(Homo
sapiens) 		4 / 6 ALA A 134
LEU A 132
ILE A 121
SER A 337
 None
 1.05A 1sbrA-6bdtA:
undetectable
1sbrB-6bdtA:
undetectable		 1sbrA-6bdtA:
15.00
1sbrB-6bdtA:
15.00
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.
3AI8_A_HNQA255_1
(CATHEPSIN B)		 6bdt CALPAIN-3
(Homo
sapiens) 		4 / 7 GLN A 123
GLY A 127
HIS A 334
TRP A 360
 None
 0.47A 3ai8A-6bdtA:
7.2		 3ai8A-6bdtA:
15.42
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.
3L35_H_DHIH3_0
(GP41 N-PEPTIDE
HIV ENTRY INHIBITOR
PIE12)		 6bdt CALPAIN-3
(Homo
sapiens) 		3 / 3 LEU A 132
TRP A 130
GLY A 221
 None
 0.74A 3l35A-6bdtA:
undetectable
3l35H-6bdtA:
undetectable		 3l35A-6bdtA:
undetectable
3l35H-6bdtA:
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.
3QX3_A_EVPA1_1
(DNA TOPOISOMERASE
2-BETA)		 6bdt CALPAIN-3
(Homo
sapiens) 		4 / 5 GLY A 395
ASP A 394
ARG A 355
MET A 228
 None
CA  A 502 (-3.3A)
None
None
 1.34A 3qx3A-6bdtA:
undetectable		 3qx3A-6bdtA:
6.94
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.
3R7M_A_SUZA332_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C3)		 6bdt CALPAIN-3
(Homo
sapiens) 		5 / 10 LEU A 219
TRP A 130
HIS A 213
PHE A 167
PHE A 231
 None
 1.50A 3r7mA-6bdtA:
undetectable		 3r7mA-6bdtA:
14.91
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.
3RV5_A_DXCA91_0
(TROPONIN C, SLOW
SKELETAL AND CARDIAC
MUSCLES)		 6bdt CALPAIN-3
(Homo
sapiens) 		3 / 3 PHE A 231
GLN A 142
PHE A 131
 None
 0.53A 3rv5A-6bdtA:
undetectable		 3rv5A-6bdtA:
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.
4DC3_B_2FAB401_2
(ADENOSINE KINASE)		 6bdt CALPAIN-3
(Homo
sapiens) 		4 / 5 LEU A 261
ILE A 135
ALA A 227
PHE A 231
 None
 1.08A 4dc3B-6bdtA:
undetectable		 4dc3B-6bdtA:
16.10
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.
5HWA_A_GCSA302_1
(CHITOSANASE)		 6bdt CALPAIN-3
(Homo
sapiens) 		4 / 7 THR A 409
ASP A 267
GLY A 333
TYR A 336
 None
 1.13A 5hwaA-6bdtA:
undetectable		 5hwaA-6bdtA:
14.79
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.
5LG3_B_Z80B401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)		 6bdt CALPAIN-3
(Homo
sapiens) 		5 / 9 ILE A 149
PHE A 165
THR A 139
ASP A 120
ILE A 135
 None
None
None
CA  A 501 (-2.2A)
None
 1.24A 5lg3B-6bdtA:
undetectable		 5lg3B-6bdtA:
15.44
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.
5LG3_C_Z80C401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)		 6bdt CALPAIN-3
(Homo
sapiens) 		5 / 9 ILE A 149
PHE A 165
THR A 139
ASP A 120
ILE A 135
 None
None
None
CA  A 501 (-2.2A)
None
 1.20A 5lg3C-6bdtA:
undetectable		 5lg3C-6bdtA:
15.44
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.
5LG3_D_Z80D401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)		 6bdt CALPAIN-3
(Homo
sapiens) 		5 / 9 ILE A 149
PHE A 165
THR A 139
ASP A 120
ILE A 135
 None
None
None
CA  A 501 (-2.2A)
None
 1.22A 5lg3D-6bdtA:
undetectable		 5lg3D-6bdtA:
15.44
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.
5LG3_H_Z80H401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)		 6bdt CALPAIN-3
(Homo
sapiens) 		5 / 10 ILE A 149
PHE A 165
THR A 139
ASP A 120
ILE A 135
 None
None
None
CA  A 501 (-2.2A)
None
 1.22A 5lg3H-6bdtA:
undetectable		 5lg3H-6bdtA:
15.44
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.
5ZRF_F_EVPF1301_1
()		 6bdt CALPAIN-3
(Homo
sapiens) 		4 / 4 GLY A 395
ASP A 394
ARG A 355
MET A 228
 None
CA  A 502 (-3.3A)
None
None
 1.29A 5zrfA-6bdtA:
undetectable		 5zrfA-6bdtA:
6.94