GUID |
https://w3id.org/psnpbind/variant/630/ligand/CHEMBL85030 |
PDB ID |
4gr0 |
Variant Type |
TA215I |
Ligand ID (ChEMBL ID) |
CHEMBL85030 |
Ligand Similarity* to the one in the experimentally obtained structure of the 4gr0 complex * Tanimoto similarity obtained from the comparison of the FP2 fingerprint of the ligands, calculated using OpenBabel |
0.643411 |
Binding Affinity |
|
Binding Affiniy against the Wild-type protein |
|
| WT | Conformer 1: -6.6 Kcal/Mol |
