Complexes after comparative docking

Receptor: model based on 1LCJ 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
CHAIN_B_2 0.000 3.4 0.25 66.7 PHOSPHOPEPTIDE EPQ(PHOSPHO)YEEIPIYL 1LCJ Raw
PHS_B_3 0.000 3.7 0.61 100.0 PHOSPHONIC ACID 1LCJ Raw