SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1wly'

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.
1FSL_A_NIOA145_1
(LEGHEMOGLOBIN A)		 1wly 2-HALOACRYLATE
REDUCTASE
(Burkholderia
sp.
WS) 		4 / 8 TYR A 219
ILE A 151
HIS A 141
LEU A 137
 TYR  A 219 ( 1.3A)
ILE  A 151 ( 0.7A)
HIS  A 141 ( 1.0A)
LEU  A 137 ( 0.6A)
 0.88A 1fslA-1wlyA:
undetectable		 1fslA-1wlyA:
19.70
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.
2KCE_A_D16A566_2
(THYMIDYLATE SYNTHASE)		 1wly 2-HALOACRYLATE
REDUCTASE
(Burkholderia
sp.
WS) 		3 / 3 HIS A 299
ILE A 161
LEU A 189
 HIS  A 299 ( 1.0A)
ILE  A 161 ( 0.6A)
LEU  A 189 ( 0.6A)
 0.66A 2kceA-1wlyA:
undetectable		 2kceA-1wlyA:
20.00
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.
2QX6_A_ML1A233_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 1wly 2-HALOACRYLATE
REDUCTASE
(Burkholderia
sp.
WS) 		4 / 6 PHE A 306
ILE A 327
GLY A 320
GLY A 319
 PHE  A 306 ( 1.3A)
ILE  A 327 ( 0.6A)
GLY  A 320 ( 0.0A)
GLY  A 319 ( 0.0A)
 0.81A 2qx6A-1wlyA:
3.4
2qx6B-1wlyA:
3.4		 2qx6A-1wlyA:
24.24
2qx6B-1wlyA:
24.24
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.
2WEK_B_DIFB1376_1
(ZINC-BINDING ALCOHOL
DEHYDROGENASE
DOMAIN-CONTAINING
PROTEIN 2)		 1wly 2-HALOACRYLATE
REDUCTASE
(Burkholderia
sp.
WS) 		4 / 7 VAL A 302
GLY A 125
ALA A 124
SER A 300
 VAL  A 302 ( 0.6A)
GLY  A 125 ( 0.0A)
ALA  A 124 ( 0.0A)
SER  A 300 ( 0.0A)
 0.93A 2wekB-1wlyA:
32.3		 2wekB-1wlyA:
29.78
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.
4HVR_A_SALA203_1
(3-HYDROXYANTHRANILAT
E 3,4-DIOXYGENASE)		 1wly 2-HALOACRYLATE
REDUCTASE
(Burkholderia
sp.
WS) 		4 / 7 GLU A  19
HIS A   8
PRO A  61
VAL A  21
 GLU  A  19 ( 0.6A)
HIS  A   8 ( 1.0A)
PRO  A  61 ( 1.1A)
VAL  A  21 ( 0.6A)
 1.03A 4hvrA-1wlyA:
undetectable		 4hvrA-1wlyA:
16.62
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.
4KMM_B_CHDB503_0
(FERROCHELATASE,
MITOCHONDRIAL)		 1wly 2-HALOACRYLATE
REDUCTASE
(Burkholderia
sp.
WS) 		4 / 5 MET A 127
LEU A 289
ARG A  87
SER A 326
 MET  A 127 ( 0.0A)
LEU  A 289 ( 0.6A)
ARG  A  87 ( 0.6A)
SER  A 326 ( 0.0A)
 1.49A 4kmmB-1wlyA:
3.9		 4kmmB-1wlyA:
22.00
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.
4LUH_A_ACTA608_0
(SERUM ALBUMIN)		 1wly 2-HALOACRYLATE
REDUCTASE
(Burkholderia
sp.
WS) 		4 / 4 PRO A 113
ASP A 115
LEU A 116
ARG A  87
 PRO  A 113 ( 1.1A)
ASP  A 115 ( 0.5A)
LEU  A 116 ( 0.6A)
ARG  A  87 ( 0.6A)
 1.42A 4luhA-1wlyA:
0.0		 4luhA-1wlyA:
19.24
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.
4QN9_B_DXCB610_0
(N-ACYL-PHOSPHATIDYLE
THANOLAMINE-HYDROLYZ
ING PHOSPHOLIPASE D)		 1wly 2-HALOACRYLATE
REDUCTASE
(Burkholderia
sp.
WS) 		3 / 3 GLY A  12
PRO A  13
ALA A 311
 GLY  A  12 ( 0.0A)
PRO  A  13 ( 1.1A)
ALA  A 311 ( 0.0A)
 0.53A 4qn9B-1wlyA:
undetectable		 4qn9B-1wlyA:
18.98
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.
4R20_B_AERB602_1
(CYTOCHROME P450
FAMILY 17
POLYPEPTIDE 2)		 1wly 2-HALOACRYLATE
REDUCTASE
(Burkholderia
sp.
WS) 		5 / 9 ALA A 166
ILE A 209
VAL A 206
GLY A 175
VAL A 215
 ALA  A 166 ( 0.0A)
ILE  A 209 ( 0.7A)
VAL  A 206 ( 0.6A)
GLY  A 175 ( 0.0A)
VAL  A 215 ( 0.6A)
 1.20A 4r20B-1wlyA:
undetectable		 4r20B-1wlyA:
21.40
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.
4XDT_A_ACTA407_0
(FAD:PROTEIN FMN
TRANSFERASE)		 1wly 2-HALOACRYLATE
REDUCTASE
(Burkholderia
sp.
WS) 		3 / 3 ASP A 225
GLY A 223
ASP A 220
 ASP  A 225 ( 0.5A)
GLY  A 223 ( 0.0A)
ASP  A 220 ( 0.6A)
 0.62A 4xdtA-1wlyA:
undetectable		 4xdtA-1wlyA:
21.20
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.
5EB5_A_010A609_0
(HNL ISOENZYME 5)		 1wly 2-HALOACRYLATE
REDUCTASE
(Burkholderia
sp.
WS) 		5 / 11 ALA A  69
ALA A  37
VAL A 328
HIS A 122
VAL A 302
 ALA  A  69 ( 0.0A)
ALA  A  37 ( 0.0A)
VAL  A 328 ( 0.6A)
HIS  A 122 ( 1.0A)
VAL  A 302 ( 0.6A)
 1.32A 5eb5A-1wlyA:
undetectable		 5eb5A-1wlyA:
22.55
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.
5EB5_B_010B607_0
(HNL ISOENZYME 5)		 1wly 2-HALOACRYLATE
REDUCTASE
(Burkholderia
sp.
WS) 		5 / 10 ALA A  69
ALA A  37
VAL A 328
LEU A 118
HIS A 122
 ALA  A  69 ( 0.0A)
ALA  A  37 ( 0.0A)
VAL  A 328 ( 0.6A)
LEU  A 118 ( 0.6A)
HIS  A 122 ( 1.0A)
 1.44A 5eb5B-1wlyA:
undetectable		 5eb5B-1wlyA:
22.55
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.
5I3C_A_AC2A301_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE)		 1wly 2-HALOACRYLATE
REDUCTASE
(Burkholderia
sp.
WS) 		5 / 9 SER A 326
GLY A  39
ALA A 314
VAL A  40
ILE A  38
 SER  A 326 ( 0.0A)
GLY  A  39 ( 0.0A)
ALA  A 314 ( 0.0A)
VAL  A  40 ( 0.6A)
ILE  A  38 ( 0.6A)
 1.35A 5i3cA-1wlyA:
undetectable		 5i3cA-1wlyA:
21.08
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.
5KQX_A_ROCA101_2
(PROTEASE E35D-SQV)		 1wly 2-HALOACRYLATE
REDUCTASE
(Burkholderia
sp.
WS) 		5 / 9 LEU A 234
VAL A 206
ILE A 195
GLY A 175
ILE A 151
 LEU  A 234 ( 0.6A)
VAL  A 206 ( 0.6A)
ILE  A 195 ( 0.7A)
GLY  A 175 ( 0.0A)
ILE  A 151 ( 0.7A)
 1.03A 5kqxB-1wlyA:
undetectable		 5kqxB-1wlyA:
13.31