SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2xty'

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.
1FXV_B_PNNB1001_0
(PENICILLIN ACYLASE)		 2xty QNRB1
(Klebsiella
pneumoniae) 		4 / 7 PHE A  56
SER A  79
ALA A  94
PHE A  96
 None
 1.16A 1fxvA-2xtyA:
undetectable
1fxvB-2xtyA:
undetectable		 1fxvA-2xtyA:
20.50
1fxvB-2xtyA:
16.01
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.
3A25_A_SAMA279_0
(UNCHARACTERIZED
PROTEIN PH0793)		 2xty QNRB1
(Klebsiella
pneumoniae) 		5 / 12 PHE A  56
GLY A  32
ILE A  10
ASP A  34
PHE A  45
 None
 1.12A 3a25A-2xtyA:
undetectable		 3a25A-2xtyA:
18.54
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.
3FL9_A_TOPA200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 2xty QNRB1
(Klebsiella
pneumoniae) 		5 / 10 ALA A  91
ALA A 114
ILE A  84
LEU A  61
PHE A  66
 None
 1.20A 3fl9A-2xtyA:
undetectable		 3fl9A-2xtyA:
21.24
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.
3FL9_F_TOPF200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 2xty QNRB1
(Klebsiella
pneumoniae) 		5 / 10 ALA A  91
ALA A 114
ILE A  84
LEU A  61
PHE A  66
 None
 1.23A 3fl9F-2xtyA:
undetectable		 3fl9F-2xtyA:
21.24
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.
3KO0_B_TFPB201_1
(PROTEIN S100-A4)		 2xty QNRB1
(Klebsiella
pneumoniae) 		4 / 8 GLY A  93
ILE A 116
PHE A 171
PHE A 164
 None
 0.97A 3ko0B-2xtyA:
undetectable
3ko0J-2xtyA:
undetectable		 3ko0B-2xtyA:
21.21
3ko0J-2xtyA:
21.21
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.
3T3R_A_9PLA501_1
(CYTOCHROME P450 2A6)		 2xty QNRB1
(Klebsiella
pneumoniae) 		5 / 11 PHE A  96
PHE A 101
ILE A  86
LEU A 131
PHE A 126
 None
 1.12A 3t3rA-2xtyA:
undetectable		 3t3rA-2xtyA:
18.92
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.
4QOP_C_HQEC503_1
(CATALASE)		 2xty QNRB1
(Klebsiella
pneumoniae) 		4 / 8 PHE A  76
LEU A  61
LEU A  71
PHE A  45
 None
 0.88A 4qopC-2xtyA:
undetectable		 4qopC-2xtyA:
18.20
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.
4ZE1_A_X2NA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 2xty QNRB1
(Klebsiella
pneumoniae) 		5 / 12 GLY A  -2
LEU A  35
PHE A  76
PHE A  66
HIS A   0
 None
 1.31A 4ze1A-2xtyA:
undetectable		 4ze1A-2xtyA:
17.33
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.
5A7M_A_ACTA1923_0
(BETA-XYLOSIDASE)		 2xty QNRB1
(Klebsiella
pneumoniae) 		3 / 3 ASP A  70
ARG A  90
TYR A  46
 None
 0.84A 5a7mA-2xtyA:
undetectable		 5a7mA-2xtyA:
15.73
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.
5A7M_B_ACTB1924_0
(BETA-XYLOSIDASE)		 2xty QNRB1
(Klebsiella
pneumoniae) 		3 / 3 ASP A  70
ARG A  90
TYR A  46
 None
 0.85A 5a7mB-2xtyA:
undetectable		 5a7mB-2xtyA:
15.73
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.
5W3J_B_TA1B502_1
(TUBULIN BETA CHAIN)		 2xty QNRB1
(Klebsiella
pneumoniae) 		4 / 8 VAL A 189
ASP A 190
GLN A 192
GLY A 193
 None
 0.84A 5w3jB-2xtyA:
undetectable		 5w3jB-2xtyA:
19.52