Complexes after comparative docking

Receptor: model based on 3H7C chain:X
& 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
211_X_8 0.000 3.5 0.7 74.1 2,2 ,2 -NITRILOTRIETHANOL 3H7C Raw