SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'TRO'


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.
3A51_B_VDYB6178_1
(VITAMIN D
HYDROXYLASE)
1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE

(Comamonas
testosteroni)
5 / 12 ASN A  51
THR A 495
VAL A 520
PRO A 524
LEU A 500
None
GOL  A1820 ( 4.7A)
None
None
TRO  A 512 ( 4.2A)
1.36A 3a51B-1kb0A:
0.0
3a51B-1kb0A:
21.29
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.
5I3C_B_AC2B301_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE)
1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE

(Comamonas
testosteroni)
5 / 10 SER A  42
GLY A 488
ALA A 502
VAL A 490
ASP A  45
None
None
TRO  A 512 ( 3.9A)
None
None
1.14A 5i3cB-1kb0A:
undetectable
5i3cB-1kb0A:
16.89