SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3aj6'

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.
3SPK_B_TPVB100_1
(HIV-1 PROTEASE)		 3aj6 MAIN HEMAGGLUTININ
COMPONENT
(Clostridium
botulinum) 		5 / 9 LEU A 158
ASN A 278
VAL A 268
ILE A 244
THR A 156
 None
 1.26A 3spkA-3aj6A:
undetectable		 3spkA-3aj6A:
14.74
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.
4EIL_A_FOLA703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3aj6 MAIN HEMAGGLUTININ
COMPONENT
(Clostridium
botulinum) 		5 / 11 VAL A  82
ASP A  65
PHE A  16
VAL A  35
THR A  67
 None
 1.45A 4eilA-3aj6A:
undetectable		 4eilA-3aj6A:
18.74
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)		 3aj6 MAIN HEMAGGLUTININ
COMPONENT
(Clostridium
botulinum) 		5 / 7 LEU A 158
ASN A 278
ASP A 271
VAL A 268
THR A 156
 None
 1.38A 4eyrA-3aj6A:
undetectable		 4eyrA-3aj6A:
14.74
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.
4KYA_C_FOLC703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3aj6 MAIN HEMAGGLUTININ
COMPONENT
(Clostridium
botulinum) 		5 / 10 VAL A  82
ASP A  65
PHE A  16
VAL A  35
THR A  67
 None
 1.50A 4kyaC-3aj6A:
undetectable		 4kyaC-3aj6A:
18.74
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.
4OBW_A_SAMA602_1
(2-METHOXY-6-POLYPREN
YL-1,4-BENZOQUINOL
METHYLASE,
MITOCHONDRIAL)		 3aj6 MAIN HEMAGGLUTININ
COMPONENT
(Clostridium
botulinum) 		3 / 3 ASP A 271
ASN A 215
SER A 260
 None
 0.75A 4obwA-3aj6A:
undetectable		 4obwA-3aj6A:
19.93
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.
6BAA_E_GBME2001_2
(ATP-BINDING CASSETTE
SUB-FAMILY C MEMBER
8)		 3aj6 MAIN HEMAGGLUTININ
COMPONENT
(Clostridium
botulinum) 		3 / 3 LEU A 147
THR A   4
ASN A   5
 None
 0.71A 6baaE-3aj6A:
undetectable		 6baaE-3aj6A:
11.16
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.
6BAA_F_GBMF2001_2
(ATP-BINDING CASSETTE
SUB-FAMILY C MEMBER
8)		 3aj6 MAIN HEMAGGLUTININ
COMPONENT
(Clostridium
botulinum) 		3 / 3 LEU A 147
THR A   4
ASN A   5
 None
 0.71A 6baaF-3aj6A:
undetectable		 6baaF-3aj6A:
11.16
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.
6BAA_G_GBMG2001_2
(ATP-BINDING CASSETTE
SUB-FAMILY C MEMBER
8)		 3aj6 MAIN HEMAGGLUTININ
COMPONENT
(Clostridium
botulinum) 		3 / 3 LEU A 147
THR A   4
ASN A   5
 None
 0.72A 6baaG-3aj6A:
undetectable		 6baaG-3aj6A:
11.16
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.
6BAA_H_GBMH2001_2
(ATP-BINDING CASSETTE
SUB-FAMILY C MEMBER
8)		 3aj6 MAIN HEMAGGLUTININ
COMPONENT
(Clostridium
botulinum) 		3 / 3 LEU A 147
THR A   4
ASN A   5
 None
 0.72A 6baaH-3aj6A:
undetectable		 6baaH-3aj6A:
11.16