Complexes after comparative docking

Receptor: model based on 3FUR 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
Z12_A_3 0.000 10.7 0.75 45.1 2,4-DICHLORO-N-[3,5-DICHLORO-4-(QUINOLIN-3-YLOXY)PHENYL]BENZENESULFONAMIDE 3FUR Raw