PSnpBind - Pocket SNPs effect on protein-ligand binding affinity

GUID	https://w3id.org/psnpbind/variant/399/ligand/CHEMBL1224193
PDB ID	3b27
Variant Type	KA58R
Ligand ID (ChEMBL ID)	CHEMBL1224193
Ligand Similarity* to the one in the experimentally obtained structure of the 3b27 complex * Tanimoto similarity obtained from the comparison of the FP2 fingerprint of the ligands, calculated using OpenBabel	0.656716
Binding Affinity	Conformer 1: -7.9 Kcal/Mol Conformer 2: -7.4 Kcal/Mol Conformer 3: -7.2 Kcal/Mol
Binding Affiniy against the Wild-type protein
WT	Conformer 1: -7.6 Kcal/Mol