PSnpBind - Pocket SNPs effect on protein-ligand binding affinity

GUID	https://w3id.org/psnpbind/variant/505/ligand/CHEMBL3652019
PDB ID	2c3i
Variant Type	YB53H
Ligand ID (ChEMBL ID)	CHEMBL3652019
Ligand Similarity* to the one in the experimentally obtained structure of the 2c3i complex * Tanimoto similarity obtained from the comparison of the FP2 fingerprint of the ligands, calculated using OpenBabel	0.929412
Binding Affinity	Conformer 1: -10.1 Kcal/Mol Conformer 2: -9.6 Kcal/Mol Conformer 3: -9.3 Kcal/Mol
Binding Affiniy against the Wild-type protein
WT	Conformer 1: -10.4 Kcal/Mol