Complexes after comparative docking

Receptor: model based on 4B9U 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_B_2 0.000 10.3 0.52 10.1 5 -D(*GP*CP*CP*TP*GP*AP*CP*TP*CP*GP*AP)-3 4B9U Raw