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.
1JS3_A_142A701_1
(DOPA DECARBOXYLASE)
4e1o HISTIDINE
DECARBOXYLASE
(Homo
sapiens)
5 / 9TRP A  72
TYR A  80
HIS A 194
THR A 248
LYS A 305
None
PVH  A1001 (-4.9A)
PLP  A1000 ( 3.3A)
PLP  A1000 (-3.1A)
PLP  A1000 ( 3.1A)
0.38A50.72
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1JS3_B_142B702_1
(DOPA DECARBOXYLASE)
4e1o HISTIDINE
DECARBOXYLASE
(Homo
sapiens)
5 / 9TRP A  72
TYR A  80
HIS A 194
THR A 248
LYS A 305
None
PVH  A1001 (-4.9A)
PLP  A1000 ( 3.3A)
PLP  A1000 (-3.1A)
PLP  A1000 ( 3.1A)
0.39A50.72