GUID |
https://w3id.org/psnpbind/variant/525/ligand/CHEMBL122576 |
PDB ID |
2hb1 |
Variant Type |
AA217T |
Ligand ID (ChEMBL ID) |
CHEMBL122576 |
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 |
0.688172 |
Binding Affinity |
|
Binding Affiniy against the Wild-type protein |
|
| WT | Conformer 1: -6.9 Kcal/Mol |
