Complexes after comparative docking

Receptor: model based on 3T1U chain:A
& 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
CHAIN_B_2 0.000 7.4 0.41 27.3 succinyl-Ala-Phe-Pro-Phe-p-nitroanilide 3T1U Raw