SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '37T'


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.
4PGH_B_SAMB401_0
(CAFFEIC ACID
O-METHYLTRANSFERASE)		 2efj 3,7-DIMETHYLXANTHINE
METHYLTRANSFERASE
(Coffea
canephora) 		5 / 12 ASP A  58
GLY A  60
THR A  70
ASP A 100
TRP A 161
 SAH  A 501 ( 4.7A)
SAH  A 501 (-3.8A)
None
SAH  A 501 (-3.0A)
37T  A 502 (-4.0A)
 1.23A 4pghB-2efjA:
13.7		 4pghB-2efjA:
21.90
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.
5EB5_B_010B607_0
(HNL ISOENZYME 5)		 2efj 3,7-DIMETHYLXANTHINE
METHYLTRANSFERASE
(Coffea
canephora) 		5 / 10 ALA A 357
VAL A 329
HIS A 324
VAL A 328
TYR A 368
 None
None
None
None
37T  A 502 (-3.1A)
 1.17A 5eb5B-2efjA:
undetectable		 5eb5B-2efjA:
22.68
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_A_P06A801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 2efj 3,7-DIMETHYLXANTHINE
METHYLTRANSFERASE
(Coffea
canephora) 		4 / 7 ILE A  74
PHE A 292
PHE A 225
PHE A  27
 None
None
None
37T  A 502 (-4.6A)
 1.11A 5hieA-2efjA:
undetectable		 5hieA-2efjA:
21.52