Complexes after comparative docking

Receptor: model based on 2A7G chain:E
& Ligands found in homologous templates


Theoretical pKd : [ ‹nMol | ‹μMol | ‹mMol | ›mMol] - Values:

Score for Scwrl (Unconserved side chains of binding site are recalculated) model :

Result RMS (ca) pKd Avg. Q PSim Ligand Name : Origin Transfer
ACY_E_11 0.000 3.9 0.34 86.1 ACETIC ACID 2A7G Raw