Complexes after comparative docking

Receptor: model based on 4MUI 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
2DQ_B_10 0.000 6.8 0.7 50.0 (5-METHOXY-2-{[(4-METHOXYPHENYL)SULFONYL]CARBAMOYL}-1H-INDOL-1-YL)ACETIC ACID 4MUI Raw