Complexes after comparative docking

Receptor: model based on 1E1O 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
GOL_B_11 0.000 2.1 0.54 0.0 GLYCEROL 1E1O Raw
LYS_B_3 0.000 3.3 0.6 29.8 LYSINE 1E1O Raw