Complexes after comparative docking

Receptor: model based on 1Q0L 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
NDP_E_5 0.000 10.9 0.97 10.4 NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE 1Q0L Raw
FOM_C_3 0.000 3.7 0.72 50.8 3-[FORMYL(HYDROXY)AMINO]PROPYLPHOSPHONIC ACID 1Q0L Raw