POTENTIAL TARGETS FROM HUMAN (RESULTS FROM SUB-STRUCTURAL SIMILARITY SEARCHES)
1) User may click on the DrReposER ID (the second column) to get information on the binding sites and drug molecule.
2) Click View (the second last column) to view matched residues and superposition in the NGL viewer (upper right part).
3) User may also click on the Dock (the last column) to get script for molecular docking in UCSF Chimera through AutoDock Vina.


DrReposER ID / Desc. Hit
PDBID
Hit
Macromolecule
Res.
Matches
Interface HETATM RMSD Seq.
Identity (%)
View Dock
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1U65_A_CP0A1000_1
(ACETYLCHOLINESTERASE)
1b41 ACETYLCHOLINESTERASE
(Homo
sapiens)
5 / 11TYR A  72
TRP A  86
GLU A 202
TYR A 341
HIS A 447
None
0.76A57.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1U65_A_CP0A1000_1
(ACETYLCHOLINESTERASE)
1b41 ACETYLCHOLINESTERASE
(Homo
sapiens)
7 / 11TYR A  72
TRP A  86
TYR A 124
GLU A 202
TRP A 286
LEU A 289
HIS A 447
None
0.46A57.67