Input protein PDB structure
LigBind only predicts one protein chain once, please input 1-character chain ID (case sensitive) in the text boxes. If your PDB file does not contain a chain ID, just leave it blank.
Prediction of binding residues for a specific ligand
Prediction of binding residues for unknown ligands
Email address(Optional, where the results will be sent to)
Ying Xia, Xiaoyong Pan, Hong-Bin Shen. LigBind: identifying binding residues for over 1000 ligands with relation-aware graph neural networks. 2023.