SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4UW'


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.
1XVA_A_ACTA294_0
(GLYCINE
N-METHYLTRANSFERASE)		 5bsw 4-COUMARATE--COA
LIGASE 2
(Nicotiana
tabacum) 		4 / 5 ILE A 238
LEU A 341
ALA A 338
GLU A 337
 None
None
None
4UW  A 600 ( 4.6A)
 1.21A 1xvaA-5bswA:
3.3
1xvaB-5bswA:
2.3		 1xvaA-5bswA:
18.81
1xvaB-5bswA:
18.81
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.
1XVA_B_ACTB294_0
(GLYCINE
N-METHYLTRANSFERASE)		 5bsw 4-COUMARATE--COA
LIGASE 2
(Nicotiana
tabacum) 		4 / 6 ALA A 338
GLU A 337
ILE A 238
LEU A 341
 None
4UW  A 600 ( 4.6A)
None
None
 1.04A 1xvaA-5bswA:
3.3
1xvaB-5bswA:
2.3		 1xvaA-5bswA:
18.81
1xvaB-5bswA:
18.81
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.
2XRH_A_NIOA200_1
(PROTEIN HP0721)		 5bsw 4-COUMARATE--COA
LIGASE 2
(Nicotiana
tabacum) 		4 / 7 GLY A 339
ILE A 394
GLN A 212
LEU A 341
 4UW  A 600 ( 4.8A)
None
None
None
 0.95A 2xrhA-5bswA:
undetectable		 2xrhA-5bswA:
13.56
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.
2ZUL_A_SAMA376_1
(PROBABLE RIBOSOMAL
RNA SMALL SUBUNIT
METHYLTRANSFERASE)		 5bsw 4-COUMARATE--COA
LIGASE 2
(Nicotiana
tabacum) 		3 / 3 SER A 523
GLU A 337
ASP A 401
 None
4UW  A 600 ( 4.6A)
None
 0.80A 2zulA-5bswA:
undetectable		 2zulA-5bswA:
22.22
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.
3BJW_B_SVRB501_2
(PHOSPHOLIPASE A2)		 5bsw 4-COUMARATE--COA
LIGASE 2
(Nicotiana
tabacum) 		5 / 11 LEU A 286
ILE A 526
LYS A 525
PRO A 522
SER A 523
 None
None
4UW  A 600 (-2.7A)
None
None
 1.27A 3bjwB-5bswA:
undetectable		 3bjwB-5bswA:
11.23
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.
3BJW_E_SVRE503_1
(PHOSPHOLIPASE A2)		 5bsw 4-COUMARATE--COA
LIGASE 2
(Nicotiana
tabacum) 		5 / 11 LEU A 286
ILE A 526
LYS A 525
PRO A 522
SER A 523
 None
None
4UW  A 600 (-2.7A)
None
None
 1.30A 3bjwE-5bswA:
undetectable		 3bjwE-5bswA:
11.23
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.
3BJW_H_SVRH504_3
(PHOSPHOLIPASE A2)		 5bsw 4-COUMARATE--COA
LIGASE 2
(Nicotiana
tabacum) 		5 / 11 LEU A 286
ILE A 526
LYS A 525
PRO A 522
SER A 523
 None
None
4UW  A 600 (-2.7A)
None
None
 1.24A 3bjwH-5bswA:
undetectable		 3bjwH-5bswA:
11.23
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.
3DMH_A_SAMA384_1
(PROBABLE RIBOSOMAL
RNA SMALL SUBUNIT
METHYLTRANSFERASE)		 5bsw 4-COUMARATE--COA
LIGASE 2
(Nicotiana
tabacum) 		3 / 3 SER A 523
GLU A 337
ASP A 401
 None
4UW  A 600 ( 4.6A)
None
 0.82A 3dmhA-5bswA:
2.5		 3dmhA-5bswA:
21.82
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.
4J7U_D_YTZD802_1
(SEPIAPTERIN
REDUCTASE)		 5bsw 4-COUMARATE--COA
LIGASE 2
(Nicotiana
tabacum) 		4 / 8 LEU A 249
CYH A  31
TYR A  30
GLN A 213
 None
None
None
4UW  A 600 ( 4.7A)
 0.91A 4j7uD-5bswA:
3.5		 4j7uD-5bswA:
21.51
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.
4JDS_A_SAMA401_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD7)		 5bsw 4-COUMARATE--COA
LIGASE 2
(Nicotiana
tabacum) 		5 / 11 ILE A 394
ALA A 338
GLY A 339
GLY A 191
TYR A 398
 None
None
4UW  A 600 ( 4.8A)
4UW  A 600 ( 4.7A)
None
 1.31A 4jdsA-5bswA:
undetectable		 4jdsA-5bswA:
18.72