Complexes after comparative docking

Receptor: model based on 3HY0 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
G5A_B_7 0.000 5.7 0.93 82.5 5 -O-(GLYCYLSULFAMOYL)ADENOSINE 3HY0 Raw