Complexes after comparative docking

Receptor: model based on 1XUP chain:O
& 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
GOL_C_3 0.000 2.5 0.61 0.0 GLYCEROL 1XUP Raw