PSnpBind - Pocket SNPs effect on protein-ligand binding affinity

GUID	https://w3id.org/psnpbind/variant/198/ligand/CHEMBL3676164
PDB ID	4crc
Variant Type	AA56T
Ligand ID (ChEMBL ID)	CHEMBL3676164
Ligand Similarity* to the one in the experimentally obtained structure of the 4crc complex * Tanimoto similarity obtained from the comparison of the FP2 fingerprint of the ligands, calculated using OpenBabel	0.625828
Binding Affinity	Conformer 1: -10.3 Kcal/Mol Conformer 2: -9.3 Kcal/Mol Conformer 3: -9.0 Kcal/Mol
Binding Affiniy against the Wild-type protein
WT	Conformer 1: -10.4 Kcal/Mol