3D binding pocket protein structure similarity virtual screening
Introduction
Algorithm
Examples
Run 3Dclick
References
Contacts
Help
Input PDB chain code
Or upload structure
(or
click here for sample query
)
Query Structure
e.g: 1zaoA
Ligand Name
e.g: ATP
Ligand Position
e.g: 286
Ligand Chain
e.g: A
Database
Small SCOP fold representatives
SCOP families (2868 PDB chains)
Proteins (32,959 PDB chains NR 95)
E.coli AlphaFold (4363 structures)
S.cerevisiae AlphaFold (6039 structures)
Human AlphaFold (23,391 structures)
User-uploaded
Email Address
Energy Minimization
Please note
: For testing the efficacy of the server, users are requested to try small datasets
as running larger datasets pushes subsequently submitted jobs into a queue with long waiting times.
