Complexes after comparative docking

Receptor: model based on 1C1D 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
NAD_A_12 0.000 9.9 0.74 88.9 NICOTINAMIDE-ADENINE-DINUCLEOTIDE 1C1D Raw