SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2qml'

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.
2W98_A_P1ZA1352_1
(PROSTAGLANDIN
REDUCTASE 2)		 2qml BH2621 PROTEIN
(Bacillus
halodurans) 		4 / 7 TYR A  83
LEU A  64
ASN A  65
TYR A  56
 None
 1.47A 2w98A-2qmlA:
0.6
2w98B-2qmlA:
0.6		 2w98A-2qmlA:
19.78
2w98B-2qmlA:
19.78
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.
2X45_B_HSMB1160_1
(ALLERGEN ARG R 1)		 2qml BH2621 PROTEIN
(Bacillus
halodurans) 		4 / 7 VAL A 168
TYR A  97
ILE A  93
ASP A 172
 None
 1.23A 2x45B-2qmlA:
1.7		 2x45B-2qmlA:
17.50
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.
2X45_C_HSMC1160_1
(ALLERGEN ARG R 1)		 2qml BH2621 PROTEIN
(Bacillus
halodurans) 		4 / 7 VAL A 168
TYR A  97
ILE A  93
ASP A 172
 None
 1.21A 2x45C-2qmlA:
undetectable		 2x45C-2qmlA:
17.50
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.
3BU1_A_HSMA301_1
(LIPOCALIN)		 2qml BH2621 PROTEIN
(Bacillus
halodurans) 		4 / 7 VAL A 168
TYR A  97
ILE A  93
ASP A 172
 None
 1.18A 3bu1A-2qmlA:
undetectable		 3bu1A-2qmlA:
16.82
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.
3L4W_A_MIGA1001_1
(MALTASE-GLUCOAMYLASE
, INTESTINAL)		 2qml BH2621 PROTEIN
(Bacillus
halodurans) 		5 / 12 TYR A  87
ASP A  92
ILE A  94
ILE A  93
HIS A  68
 None
 1.30A 3l4wA-2qmlA:
undetectable		 3l4wA-2qmlA:
12.63
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.
4A97_J_ZPCJ1318_2
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 2qml BH2621 PROTEIN
(Bacillus
halodurans) 		4 / 5 GLU A  85
PHE A  63
TYR A  56
HIS A  39
 None
 1.41A 4a97J-2qmlA:
undetectable		 4a97J-2qmlA:
20.61
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.
4XLD_A_BRLA502_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 2qml BH2621 PROTEIN
(Bacillus
halodurans) 		5 / 12 PHE A 185
GLY A 161
CYH A 180
PHE A 134
LEU A 126
 None
 1.35A 4xldA-2qmlA:
undetectable		 4xldA-2qmlA:
22.33
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.
4XQG_A_AG2A505_1
(HOMOSPERMIDINE
SYNTHASE)		 2qml BH2621 PROTEIN
(Bacillus
halodurans) 		4 / 8 ARG A  24
VAL A  26
ASP A  29
ASP A  30
 None
 1.09A 4xqgA-2qmlA:
undetectable		 4xqgA-2qmlA:
17.36
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.
4XQG_B_AG2B505_1
(HOMOSPERMIDINE
SYNTHASE)		 2qml BH2621 PROTEIN
(Bacillus
halodurans) 		4 / 8 ARG A  24
VAL A  26
ASP A  29
ASP A  30
 None
 1.09A 4xqgB-2qmlA:
undetectable		 4xqgB-2qmlA:
17.36