Complexes after comparative docking

Receptor: model based on 1LRU chain:C
& 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
BB2_C_11 0.000 5.8 0.69 89.4 ACTINONIN 1LRU Raw