PSnpBind - Pocket SNPs effect on protein-ligand binding affinity

GUID	https://w3id.org/psnpbind/variant/528/ligand/CHEMBL212296
PDB ID	2hb1
Variant Type	SA222A
Ligand ID (ChEMBL ID)	CHEMBL212296
Ligand Similarity* to the one in the experimentally obtained structure of the 2hb1 complex * Tanimoto similarity obtained from the comparison of the FP2 fingerprint of the ligands, calculated using OpenBabel	0.790476
Binding Affinity	Conformer 1: -4.7 Kcal/Mol Conformer 2: -4.6 Kcal/Mol Conformer 3: -4.5 Kcal/Mol
Binding Affiniy against the Wild-type protein
WT	Conformer 1: -4.8 Kcal/Mol