Complexes after comparative docking

Receptor: model based on 3PH3 chain:B
& 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
RB5_B_4 0.000 2.0 0.64 86.7 SUGAR (D-XYLITOL) 3PH3 Raw