GUID |
https://w3id.org/psnpbind/variant/540/ligand/CHEMBL2386638 |
PDB ID |
4e5w |
Variant Type |
PA1044S |
Ligand ID (ChEMBL ID) |
CHEMBL2386638 |
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 |
0.861386 |
Binding Affinity |
|
Binding Affiniy against the Wild-type protein |
|
| WT | Conformer 1: -6.6 Kcal/Mol |
