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TitleAn Inhibitor-in-Pieces Approach to DAHP Synthase Inhibition: Potent Enzyme and Bacterial Growth Inhibition.
Journal, issue, pagesAcs Infect Dis., Vol. 7, Page 3292-3302, Year 2021
Publish dateAug 16, 2021 (structure data deposition date)
AuthorsHeimhalt, M. / Mukherjee, P. / Grainger, R.A. / Szabla, R. / Brown, C. / Turner, R. / Junop, M.S. / Berti, P.J.
External linksAcs Infect Dis. / PubMed:34761906
MethodsX-ray diffraction
Resolution2.5 - 2.8 Å
Structure data

PDB-7rud:
DAHP synthase complex with trifluoropyruvate oxime
Method: X-RAY DIFFRACTION / Resolution: 2.8 Å

PDB-7rue:
DAHP synthase complexed with trifluoropyruvate semicarbazone
Method: X-RAY DIFFRACTION / Resolution: 2.5 Å

Chemicals

ChemComp-7QE:
(2Z)-3,3,3-trifluoro-2-(hydroxyimino)propanoic acid

ChemComp-HOH:
WATER

ChemComp-7QH:
(2E)-2-(2-carbamoylhydrazinylidene)-3,3,3-trifluoropropanoic acid

ChemComp-MN:
Unknown entry

Source
  • escherichia coli (strain k12) (bacteria)
KeywordsTRANSFERASE/TRANSFERASE INHIBITOR / DAHP synthase / inhibitor / complex / LYASE / TRANSFERASE-TRANSFERASE INHIBITOR complex / inhibitor complex

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