Complexes after comparative docking

Receptor: model based on 1S89 chain:C
& 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
PGA_I_9 0.000 3.5 0.6 81.8 SUGAR (2-PHOSPHOGLYCOLIC ACID) 1S89 Raw