Complexes after comparative docking

Receptor: model based on 2NV7 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
555_B_6 0.000 8.0 0.79 90.5 4-(4-HYDROXYPHENYL)-1-NAPHTHALDEHYDE OXIME 2NV7 Raw