Mapping Analogous Heterogens onto Residue Interactions

Query Method

Look up a structure from a chemical/drug name, then export the SMILES and submit.

Best performance on Firefox, the applet may take a minute to load. The latest Java is required.


PDB ligand 3 letter-code

PDB Ligand Update: 10/07/2014
Created by Duangrudee Tanramluk,Lalita Narupiyakul, Ruj Akavipat, Sungsam Gong
Thanks to Tom Blundell at University of Cambridge
MB and ICBS at Mahidol University