SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2dwr'

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.
1IG3_A_VIBA502_1
(THIAMIN
PYROPHOSPHOKINASE)		 2dwr OUTER CAPSID PROTEIN
(Rotavirus
A) 		4 / 8 TRP A 102
SER A  99
ASN A  98
THR A 190
 None
 1.03A 1ig3A-2dwrA:
undetectable
1ig3B-2dwrA:
undetectable		 1ig3A-2dwrA:
19.11
1ig3B-2dwrA:
19.11
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.
2X2I_D_QPSD1060_1
(ALPHA-1,4-GLUCAN
LYASE ISOZYME 1)		 2dwr OUTER CAPSID PROTEIN
(Rotavirus
A) 		5 / 10 VAL A 130
PHE A 128
SER A 125
VAL A  91
GLY A  90
 None
None
None
None
IPA  A5000 (-4.0A)
 1.39A 2x2iD-2dwrA:
0.0		 2x2iD-2dwrA:
10.40
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.
3KP6_B_SALB3001_1
(TRANSCRIPTIONAL
REGULATOR TCAR)		 2dwr OUTER CAPSID PROTEIN
(Rotavirus
A) 		4 / 8 LYS A 136
ASN A 135
HIS A 111
ASN A 132
 None
 1.16A 3kp6A-2dwrA:
undetectable
3kp6B-2dwrA:
undetectable		 3kp6A-2dwrA:
20.47
3kp6B-2dwrA:
20.47
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.
4AC9_C_DXCC1477_0
(MJ0495-LIKE PROTEIN)		 2dwr OUTER CAPSID PROTEIN
(Rotavirus
A) 		4 / 6 THR A 175
GLY A 165
ILE A  84
LEU A 157
 None
 0.98A 4ac9C-2dwrA:
undetectable		 4ac9C-2dwrA:
13.60
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.
4PD9_A_ADNA501_2
(NUPC FAMILY PROTEIN)		 2dwr OUTER CAPSID PROTEIN
(Rotavirus
A) 		3 / 3 THR A  73
ASN A  97
PHE A 101
 None
 0.84A 4pd9A-2dwrA:
undetectable		 4pd9A-2dwrA:
15.09
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.
5ECN_D_LEUD602_0
(JASMONIC ACID-AMIDO
SYNTHETASE JAR1)		 2dwr OUTER CAPSID PROTEIN
(Rotavirus
A) 		5 / 8 ILE A 166
THR A 103
VAL A 105
TYR A  93
VAL A 173
 None
 1.37A 5ecnD-2dwrA:
undetectable		 5ecnD-2dwrA:
15.06