Complexes after comparative docking

Receptor: model based on 3UGS 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
FFT_B_3 0.000 5.3 0.48 40.2 (2Z,6Z)-3,7,11-TRIMETHYLDODECA-2,6,10-TRIEN-1-YL DIHYDROGEN PHOSPHATE 3UGS Raw