Complexes after comparative docking

Receptor: model based on 3V01 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
3V0_A_2 0.000 7.5 0.6 66.0 N-{[(2R)-2,3-DIHYDROXYPROPYL]OXY}-3-[(2-FLUORO-4-IODOPHENYL)AMINO]FURO[3,2-C]PYRIDINE-2-CARBOXAMIDE 3V01 Raw