Complexes after comparative docking

Receptor: model based on 1D9D 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_1 0.000 5.5 0.61 0.6 5 -D(*TP*CP*GP)-R(AP*(U31)P*(C31))-3 1D9D Raw