Complexes after comparative docking

Receptor: model based on 4GC6 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
0OH_A_4 0.000 4.2 0.48 81.8 NORTH-METHANOCARBA-2 -DEOXYADENOSINE TRIPHOSPHATE 4GC6 Raw