Complexes after comparative docking

Receptor: model based on 2Z6J 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
TUI_B_10 0.000 6.9 0.76 100.0 2-(4-(2-((3-(5-(PYRIDIN-2-YLTHIO)THIAZOL-2-YL)UREIDO)METHYL)-1H-IMIDAZOL-4-YL)PHENOXY)ACETIC ACID 2Z6J Raw
FMN_B_9 0.000 8.9 0.94 100.0 FLAVIN MONONUCLEOTIDE 2Z6J Raw