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TitleDiscovery of Hydroxamate Bioisosteres as KATII Inhibitors with Improved Oral Bioavailability and Pharmacokinetics
Journal, issue, pagesMEDCHEMCOMM, Year 2012
Publish dateAug 1, 2012 (structure data deposition date)
AuthorsVerhoest, P.R. / Henderson, J.L. / Sawant-Basak, A. / Tuttle, J.B. / Dounay, A.B. / McAllister, L.A. / Pandit, J. / Rong, S. / Hou, X. / Bechle, B. ...Verhoest, P.R. / Henderson, J.L. / Sawant-Basak, A. / Tuttle, J.B. / Dounay, A.B. / McAllister, L.A. / Pandit, J. / Rong, S. / Hou, X. / Bechle, B. / Parikh, V. / Evrard, E. / Ghosh, S. / Salafia, M.A. / Rago, B. / Obach, R. / Fonseca, K.R. / Chang, C.
External linksMEDCHEMCOMM / Search PubMed
MethodsX-ray diffraction
Resolution2.89 Å
Structure data

PDB-4gdy:
Kynurenine Aminotransferase II inhibitors
Method: X-RAY DIFFRACTION / Resolution: 2.89 Å

Chemicals

ChemComp-0X1:
(5-hydroxy-6-methyl-4-{[(1-oxo-7-phenoxy-1,2-dihydro[1,2,4]triazolo[4,3-a]quinolin-4-yl)amino]methyl}pyridin-3-yl)methyl dihydrogen phosphate

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSFERASE/TRANSFERASE INHIBITOR / Aminotransferase / Pyridoxal phosphate co-factor / TRANSFERASE-TRANSFERASE INHIBITOR complex

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