Complexes after comparative docking

Receptor: model based on 4GX6 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
F6P_A_3 0.000 3.5 0.85 88.5 SUGAR (FRUCTOSE-6-PHOSPHATE) 4GX6 Raw