Complexes after comparative docking

Receptor: model based on 1ZDP 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
TIO_E_7 0.000 4.5 0.6 70.5 (2-MERCAPTOMETHYL-3-PHENYL-PROPIONYL)-GLYCINE 1ZDP Raw