Complexes after comparative docking

Receptor: model based on 3I92 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
GCP_B_7 0.000 6.9 0.88 86.4 PHOSPHOMETHYLPHOSPHONIC ACID GUANYLATE ESTER 3I92 Raw