Complexes after comparative docking

Receptor: model based on 2HCR 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
AMP_B_12 0.000 3.3 0.73 97.3 ADENOSINE MONOPHOSPHATE 2HCR Raw