SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3dxq'

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.
1ERR_A_RALA600_2
(ESTROGEN RECEPTOR)		 3dxq CHOLINE/ETHANOLAMINE
KINASE FAMILY
PROTEIN
(Mesorhizobium
loti) 		4 / 6 LEU A 284
LEU A 294
LEU A 255
LEU A 258
 None
 0.87A 1errA-3dxqA:
undetectable		 1errA-3dxqA:
19.75
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.
2FUM_C_MIXC2539_1
(PROBABLE
SERINE/THREONINE-PRO
TEIN KINASE PKNB)		 3dxq CHOLINE/ETHANOLAMINE
KINASE FAMILY
PROTEIN
(Mesorhizobium
loti) 		6 / 12 LEU A  26
GLY A  27
VAL A  33
TYR A  87
ASN A 183
ASP A 195
 None
 0.85A 2fumC-3dxqA:
8.3		 2fumC-3dxqA:
25.07
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.
2QHF_A_ACTA507_0
(CHORISMATE SYNTHASE)		 3dxq CHOLINE/ETHANOLAMINE
KINASE FAMILY
PROTEIN
(Mesorhizobium
loti) 		3 / 3 LEU A 172
ASN A 202
ARG A 126
 None
 0.98A 2qhfA-3dxqA:
undetectable		 2qhfA-3dxqA:
22.63
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.
3CR4_X_PNTX101_0
(PROTEIN S100-B)		 3dxq CHOLINE/ETHANOLAMINE
KINASE FAMILY
PROTEIN
(Mesorhizobium
loti) 		3 / 3 CYH A 175
HIS A 176
PHE A 113
 None
 0.75A 3cr4X-3dxqA:
undetectable		 3cr4X-3dxqA:
14.86
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.
3JX4_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 3dxq CHOLINE/ETHANOLAMINE
KINASE FAMILY
PROTEIN
(Mesorhizobium
loti) 		4 / 6 VAL A  69
VAL A 194
TRP A 196
PHE A 184
 None
 1.46A 3jx4A-3dxqA:
undetectable
3jx4B-3dxqA:
undetectable		 3jx4A-3dxqA:
21.05
3jx4B-3dxqA:
21.05
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.
3R9W_A_ACTA506_0
(GTPASE ERA)		 3dxq CHOLINE/ETHANOLAMINE
KINASE FAMILY
PROTEIN
(Mesorhizobium
loti) 		4 / 4 GLU A 214
GLU A 182
ASN A 183
PHE A 184
 None
 1.06A 3r9wA-3dxqA:
0.2		 3r9wA-3dxqA:
22.26
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.
4DTZ_A_LDPA501_1
(CYTOCHROME P450 BM3
VARIANT 8C8)		 3dxq CHOLINE/ETHANOLAMINE
KINASE FAMILY
PROTEIN
(Mesorhizobium
loti) 		4 / 6 PHE A 123
ALA A 174
ALA A  67
LEU A 116
 None
 1.01A 4dtzA-3dxqA:
undetectable		 4dtzA-3dxqA:
20.16
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.
4DTZ_B_LDPB501_1
(CYTOCHROME P450 BM3
VARIANT 8C8)		 3dxq CHOLINE/ETHANOLAMINE
KINASE FAMILY
PROTEIN
(Mesorhizobium
loti) 		4 / 6 PHE A 123
ALA A 174
ALA A  67
LEU A 116
 None
 1.00A 4dtzB-3dxqA:
undetectable		 4dtzB-3dxqA:
20.16
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.
4MBS_B_MRVB1101_2
(CHIMERA PROTEIN OF
C-C CHEMOKINE
RECEPTOR TYPE 5 AND
RUBREDOXIN)		 3dxq CHOLINE/ETHANOLAMINE
KINASE FAMILY
PROTEIN
(Mesorhizobium
loti) 		4 / 5 THR A   3
LEU A  23
THR A  85
MET A  83
 None
 1.38A 4mbsB-3dxqA:
undetectable		 4mbsB-3dxqA:
21.99
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.
4PAE_A_NIZA804_1
(CATALASE-PEROXIDASE)		 3dxq CHOLINE/ETHANOLAMINE
KINASE FAMILY
PROTEIN
(Mesorhizobium
loti) 		4 / 6 ASP A 207
TYR A 245
LEU A 205
HIS A 117
 None
 1.15A 4paeA-3dxqA:
undetectable		 4paeA-3dxqA:
17.34
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.
5ADD_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 3dxq CHOLINE/ETHANOLAMINE
KINASE FAMILY
PROTEIN
(Mesorhizobium
loti) 		4 / 6 VAL A  69
VAL A 194
TRP A 196
PHE A 184
 None
 1.43A 5addA-3dxqA:
undetectable
5addB-3dxqA:
undetectable		 5addA-3dxqA:
21.05
5addB-3dxqA:
21.05
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.
5ADE_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 3dxq CHOLINE/ETHANOLAMINE
KINASE FAMILY
PROTEIN
(Mesorhizobium
loti) 		4 / 6 VAL A  69
VAL A 194
TRP A 196
PHE A 184
 None
 1.43A 5adeA-3dxqA:
undetectable
5adeB-3dxqA:
undetectable		 5adeA-3dxqA:
21.05
5adeB-3dxqA:
21.05
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.
5AMK_A_EF2A151_1
(CEREBLON ISOFORM 4)		 3dxq CHOLINE/ETHANOLAMINE
KINASE FAMILY
PROTEIN
(Mesorhizobium
loti) 		4 / 8 ASN A 265
PHE A 270
TRP A 256
TYR A 136
 None
 1.38A 5amkA-3dxqA:
undetectable		 5amkA-3dxqA:
17.33
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.
5HIE_D_P06D801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 3dxq CHOLINE/ETHANOLAMINE
KINASE FAMILY
PROTEIN
(Mesorhizobium
loti) 		4 / 8 ILE A 244
GLY A 240
CYH A 249
PHE A 113
 None
 0.91A 5hieD-3dxqA:
6.7		 5hieD-3dxqA:
22.09
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.
5ZW4_A_SAMA302_1
(PUTATIVE
O-METHYLTRANSFERASE
YRRM)		 3dxq CHOLINE/ETHANOLAMINE
KINASE FAMILY
PROTEIN
(Mesorhizobium
loti) 		4 / 6 GLU A  57
ARG A  42
ARG A  54
ASP A 178
 None
 1.07A 5zw4A-3dxqA:
undetectable		 5zw4A-3dxqA:
21.52