Complexes after comparative docking

Receptor: model based on 5A0V 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
NACID_E_3 0.000 12.3 0.57 87.1 5 -R(*CP*GP*CP*CP*UP*CP)-3 5A0V Raw