SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1kqr'

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.
1GTI_F_CCSF47_0
(GLUTATHIONE
S-TRANSFERASE)		 1kqr VP4
(Rotavirus
A) 		4 / 5 THR A 186
LEU A 158
GLY A 156
TYR A 165
 GOL  A4000 (-2.8A)
None
MNA  A1000 ( 4.5A)
None
 1.38A 1gtiF-1kqrA:
undetectable		 1gtiF-1kqrA:
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.
1QZR_B_CDXB901_2
(DNA TOPOISOMERASE II)		 1kqr VP4
(Rotavirus
A) 		4 / 7 THR A 186
TYR A 177
ASN A 183
LEU A 158
 GOL  A4000 (-2.8A)
None
None
None
 1.07A 1qzrB-1kqrA:
0.7		 1qzrB-1kqrA:
17.27
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.
2ZUJ_A_CAMA422_0
(CAMPHOR
5-MONOOXYGENASE)		 1kqr VP4
(Rotavirus
A) 		4 / 8 TYR A 165
THR A 176
VAL A 144
LEU A 103
 None
 0.78A 2zujA-1kqrA:
undetectable		 2zujA-1kqrA:
18.18
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.
4JX1_F_CAMF502_0
(CAMPHOR
5-MONOOXYGENASE)		 1kqr VP4
(Rotavirus
A) 		4 / 4 TYR A 152
THR A 120
VAL A  91
ILE A 128
 None
 1.49A 4jx1F-1kqrA:
undetectable		 4jx1F-1kqrA:
18.11
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.
4NKV_A_AERA601_2
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 1kqr VP4
(Rotavirus
A) 		4 / 5 LEU A  84
ASP A 142
GLU A  94
VAL A 197
 None
 1.08A 4nkvA-1kqrA:
undetectable		 4nkvA-1kqrA:
16.63
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.
5DZK_2_BEZ2801_0
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 1
BEZ-LEU-LEU)		 1kqr VP4
(Rotavirus
A) 		4 / 4 LEU A 107
ARG A 117
ILE A 106
ILE A 130
 None
 1.19A 5dzk2-1kqrA:
undetectable
5dzkM-1kqrA:
undetectable
5dzkN-1kqrA:
0.0		 5dzk2-1kqrA:
1.12
5dzkM-1kqrA:
21.88
5dzkN-1kqrA:
21.88