SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4dw1'

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.
1P6K_A_MTLA870_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4dw1 P2X PURINOCEPTOR
(Danio
rerio) 		4 / 8 ASN A 334
GLN A  58
PHE A 333
ASP A 267
 None
 1.34A 1p6kA-4dw1A:
undetectable		 1p6kA-4dw1A:
21.75
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.
2WEY_A_EV1A1771_1
(CAMP AND
CAMP-INHIBITED CGMP
3', 5'-CYCLIC
PHOSPHODIESTERASE)		 4dw1 P2X PURINOCEPTOR
(Danio
rerio) 		5 / 12 TYR A  92
LEU A 235
VAL A 190
ILE A  93
PHE A 322
 None
 1.28A 2weyA-4dw1A:
undetectable		 2weyA-4dw1A:
22.74
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.
3KO0_B_TFPB201_1
(PROTEIN S100-A4)		 4dw1 P2X PURINOCEPTOR
(Danio
rerio) 		4 / 8 GLY A 254
PHE A 233
PHE A 322
PHE A 102
 None
 0.96A 3ko0B-4dw1A:
undetectable
3ko0J-4dw1A:
undetectable		 3ko0B-4dw1A:
13.78
3ko0J-4dw1A:
13.78
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.
3KO0_D_TFPD201_1
(PROTEIN S100-A4)		 4dw1 P2X PURINOCEPTOR
(Danio
rerio) 		4 / 8 GLY A 253
PHE A 233
PHE A 322
PHE A 102
 None
 0.90A 3ko0D-4dw1A:
undetectable
3ko0E-4dw1A:
undetectable		 3ko0D-4dw1A:
13.78
3ko0E-4dw1A:
13.78
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.
3KO0_J_TFPJ201_1
(PROTEIN S100-A4)		 4dw1 P2X PURINOCEPTOR
(Danio
rerio) 		4 / 8 PHE A 322
PHE A 102
GLY A 253
PHE A 233
 None
 0.86A 3ko0B-4dw1A:
undetectable
3ko0J-4dw1A:
undetectable		 3ko0B-4dw1A:
13.78
3ko0J-4dw1A:
13.78
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.
3KO0_K_TFPK201_1
(PROTEIN S100-A4)		 4dw1 P2X PURINOCEPTOR
(Danio
rerio) 		4 / 8 GLY A 253
PHE A 233
PHE A 322
PHE A 102
 None
 0.90A 3ko0K-4dw1A:
undetectable
3ko0S-4dw1A:
undetectable		 3ko0K-4dw1A:
13.78
3ko0S-4dw1A:
13.78
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.
3KO0_M_TFPM201_1
(PROTEIN S100-A4)		 4dw1 P2X PURINOCEPTOR
(Danio
rerio) 		4 / 7 GLY A 253
PHE A 233
PHE A 322
PHE A 102
 None
 0.80A 3ko0M-4dw1A:
undetectable
3ko0P-4dw1A:
undetectable		 3ko0M-4dw1A:
13.78
3ko0P-4dw1A:
13.78
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.
3KO0_S_TFPS201_1
(PROTEIN S100-A4)		 4dw1 P2X PURINOCEPTOR
(Danio
rerio) 		4 / 7 PHE A 322
PHE A 102
GLY A 253
PHE A 233
 None
 0.87A 3ko0K-4dw1A:
undetectable
3ko0S-4dw1A:
undetectable		 3ko0K-4dw1A:
13.78
3ko0S-4dw1A:
13.78
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.
3KO0_T_TFPT201_1
(PROTEIN S100-A4)		 4dw1 P2X PURINOCEPTOR
(Danio
rerio) 		4 / 7 PHE A 322
PHE A 102
GLY A 253
PHE A 233
 None
 0.98A 3ko0R-4dw1A:
undetectable
3ko0T-4dw1A:
undetectable		 3ko0R-4dw1A:
13.78
3ko0T-4dw1A:
13.78
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.
3QOW_A_SAMA417_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE)		 4dw1 P2X PURINOCEPTOR
(Danio
rerio) 		3 / 3 THR A 124
ASP A 145
GLU A 171
 None
 0.72A 3qowA-4dw1A:
undetectable		 3qowA-4dw1A:
19.86
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.
5NKN_A_LOCA201_1
(NEUTROPHIL
GELATINASE-ASSOCIATE
D LIPOCALIN)		 4dw1 P2X PURINOCEPTOR
(Danio
rerio) 		5 / 12 GLY A 317
PHE A 299
TRP A  87
THR A 313
TYR A 303
 None
 1.43A 5nknA-4dw1A:
undetectable		 5nknA-4dw1A:
15.02
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.
5O96_B_SAMB501_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE E)		 4dw1 P2X PURINOCEPTOR
(Danio
rerio) 		5 / 9 LEU A 182
PRO A 180
GLY A 319
GLY A 253
ALA A 185
 None
 0.99A 5o96A-4dw1A:
undetectable
5o96B-4dw1A:
undetectable		 5o96A-4dw1A:
23.19
5o96B-4dw1A:
23.19
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.
5O96_H_SAMH501_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE E)		 4dw1 P2X PURINOCEPTOR
(Danio
rerio) 		5 / 10 LEU A 182
PRO A 180
GLY A 319
GLY A 253
ALA A 185
 None
 1.03A 5o96G-4dw1A:
undetectable
5o96H-4dw1A:
undetectable		 5o96G-4dw1A:
23.19
5o96H-4dw1A:
23.19