SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'XTS'


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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2EFJ_A_37TA502_1
(3,7-DIMETHYLXANTHINE
METHYLTRANSFERASE)		 2eg5 XANTHOSINE
METHYLTRANSFERASE
(Coffea
canephora) 		5 / 12 TYR A  18
TYR A 158
TRP A 162
ILE A 227
TYR A 321
 None
XTS  A 502 ( 4.9A)
XTS  A 502 (-4.5A)
None
XTS  A 502 (-4.6A)
 0.44A 2efjA-2eg5A:
47.8		 2efjA-2eg5A:
81.56
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.
2H77_A_T3A1_1
(THRA PROTEIN)		 2eg5 XANTHOSINE
METHYLTRANSFERASE
(Coffea
canephora) 		5 / 12 ILE A 246
ALA A 245
ALA A 238
LEU A 265
PHE A 329
 None
None
XTS  A 502 ( 4.3A)
None
None
 1.13A 2h77A-2eg5A:
undetectable		 2h77A-2eg5A:
21.59
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.
2H79_A_T3A1_1
(THRA PROTEIN)		 2eg5 XANTHOSINE
METHYLTRANSFERASE
(Coffea
canephora) 		5 / 12 ILE A 246
ALA A 245
ALA A 238
LEU A 265
PHE A 329
 None
None
XTS  A 502 ( 4.3A)
None
None
 1.08A 2h79A-2eg5A:
undetectable		 2h79A-2eg5A:
21.59
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.
2WA2_B_SAMB1267_1
(NON-STRUCTURAL
PROTEIN 5)		 2eg5 XANTHOSINE
METHYLTRANSFERASE
(Coffea
canephora) 		3 / 3 SER A 316
HIS A 339
ASP A 248
 XTS  A 502 (-2.5A)
None
None
 0.77A 2wa2B-2eg5A:
6.3		 2wa2B-2eg5A:
20.81
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.
4LNW_A_T3A501_1
(THYROID HORMONE
RECEPTOR ALPHA)		 2eg5 XANTHOSINE
METHYLTRANSFERASE
(Coffea
canephora) 		5 / 12 ILE A 246
ALA A 245
ALA A 238
LEU A 265
PHE A 329
 None
None
XTS  A 502 ( 4.3A)
None
None
 1.08A 4lnwA-2eg5A:
undetectable		 4lnwA-2eg5A:
21.59
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.
4LNX_A_T3A502_1
(THYROID HORMONE
RECEPTOR ALPHA)		 2eg5 XANTHOSINE
METHYLTRANSFERASE
(Coffea
canephora) 		5 / 12 ILE A 246
ALA A 245
ALA A 238
LEU A 265
PHE A 329
 None
None
XTS  A 502 ( 4.3A)
None
None
 1.09A 4lnxA-2eg5A:
undetectable		 4lnxA-2eg5A:
21.59
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.
4XNX_A_41XA707_1
(TRANSPORTER)		 2eg5 XANTHOSINE
METHYLTRANSFERASE
(Coffea
canephora) 		5 / 11 ASP A 240
ALA A 314
VAL A 317
TYR A 321
GLY A 354
 None
None
XTS  A 502 ( 4.9A)
XTS  A 502 (-4.6A)
None
 1.11A 4xnxA-2eg5A:
undetectable		 4xnxA-2eg5A:
21.88