Complexes after comparative docking

Receptor: model based on 1GLL chain:O
& 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
ACP_O_6 0.000 5.2 0.87 87.0 PHOSPHOMETHYLPHOSPHONIC ACID ADENYLATE ESTER 1GLL Raw