PSnpBind - Pocket SNPs effect on protein-ligand binding affinity

GUID	https://w3id.org/psnpbind/variant/613/ligand/CHEMBL3675572
PDB ID	4gr0
Variant Type	GA178V
Ligand ID (ChEMBL ID)	CHEMBL3675572
Ligand Similarity* to the one in the experimentally obtained structure of the 4gr0 complex * Tanimoto similarity obtained from the comparison of the FP2 fingerprint of the ligands, calculated using OpenBabel	0.618321
Binding Affinity	Conformer 1: -11.4 Kcal/Mol Conformer 2: -11.3 Kcal/Mol Conformer 3: -11.1 Kcal/Mol
Binding Affiniy against the Wild-type protein
WT	Conformer 1: -10.8 Kcal/Mol