Complexes after comparative docking

Receptor: model based on 1ANK 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
ANP_B_6 0.000 9.2 1 86.1 PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER 1ANK Raw
AMP_B_5 0.000 7.3 1 12.5 ADENOSINE MONOPHOSPHATE 1ANK Raw