Complexes after comparative docking

Receptor: model based on 1YZ9 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_F_4 0.000 4.1 0.48 16.7 5 -R(*CP*GP*AP*AP*CP*UP*UP*CP*GP*CP*G)-3 1YZ9 Raw