GUID |
https://w3id.org/psnpbind/variant/499/ligand/CHEMBL429940 |
PDB ID |
2c3i |
Variant Type |
GB45S |
Ligand ID (ChEMBL ID) |
CHEMBL429940 |
Ligand Similarity* to the one in the experimentally obtained structure of the 2c3i complex * Tanimoto similarity obtained from the comparison of the FP2 fingerprint of the ligands, calculated using OpenBabel |
0.63 |
Binding Affinity |
|
Binding Affiniy against the Wild-type protein |
|
| WT | Conformer 1: -9.5 Kcal/Mol |
