Complexes after comparative docking

Receptor: model based on 4MTW chain:E
& 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
2G7_E_13 0.000 6.0 0.68 80.7 P-((((BENZYLOXY)CARBONYL)AMINO)METHYL)-N-((S)-1-(ISOBUTYLAMINO)-4-METHYL-1-OXOPENTAN-2-YL)PHOSPHONAMIDIC ACID 4MTW Raw