Complexes after comparative docking

Receptor: model based on 4MUJ chain:A
& 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
2DU_A_6 0.000 8.3 0.71 49.3 {2-[(BENZYLSULFONYL)CARBAMOYL]-5-METHOXY-1H-INDOL-1-YL}ACETIC ACID 4MUJ Raw