PSnpBind - Pocket SNPs effect on protein-ligand binding affinity

GUID	https://w3id.org/psnpbind/variant/535/ligand/CHEMBL2436948
PDB ID	4e5w
Variant Type	VA889I
Ligand ID (ChEMBL ID)	CHEMBL2436948
Ligand Similarity* to the one in the experimentally obtained structure of the 4e5w complex * Tanimoto similarity obtained from the comparison of the FP2 fingerprint of the ligands, calculated using OpenBabel	0.938776
Binding Affinity	Conformer 1: -5.9 Kcal/Mol Conformer 2: -5.7 Kcal/Mol Conformer 3: -5.7 Kcal/Mol
Binding Affiniy against the Wild-type protein
WT	Conformer 1: -7.2 Kcal/Mol