PSnpBind - Pocket SNPs effect on protein-ligand binding affinity

GUID	https://w3id.org/psnpbind/variant/5/ligand/CHEMBL4066808
PDB ID	3jvr
Variant Type	GA101S
Ligand ID (ChEMBL ID)	CHEMBL4066808
Ligand Similarity* to the one in the experimentally obtained structure of the 3jvr complex * Tanimoto similarity obtained from the comparison of the FP2 fingerprint of the ligands, calculated using OpenBabel	0.637931
Binding Affinity	Conformer 1: -4.9 Kcal/Mol Conformer 2: -4.7 Kcal/Mol Conformer 3: -4.7 Kcal/Mol
Binding Affiniy against the Wild-type protein
WT	Conformer 1: -6.2 Kcal/Mol