Complexes after comparative docking

Receptor: model based on 2C22 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_P_2 0.000 3.0 0.47 0.6 5 -D(*GP*GP*GP*GP*GP*AP*AP*GP*GP*AP *TP*TP*C)-3 2C22 Raw