Complexes after comparative docking

Receptor: model based on 1T64 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
TSN_A_14 0.000 4.5 0.4 9.8 TRICHOSTATIN A 1T64 Raw