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Structure paper

TitleDevelopment of LpxH Inhibitors Chelating the Active Site Dimanganese Metal Cluster of LpxH.
Journal, issue, pagesChemmedchem, Vol. 18, Page e202300023-e202300023, Year 2023
Publish dateNov 9, 2021 (structure data deposition date)
AuthorsKwak, S.H. / Skyler Cochrane, C. / Cho, J. / Dome, P.A. / Ennis, A.F. / Kim, J.H. / Zhou, P. / Hong, J.
External linksChemmedchem / PubMed:37014664
MethodsX-ray diffraction
Resolution1.73 - 1.74 Å
Structure data

PDB-7ss6:
Structure of Klebsiella LpxH in complex with JH-LPH-45
Method: X-RAY DIFFRACTION / Resolution: 1.74 Å

PDB-7ss7:
Crystal structure of Klebsiella LpxH in complex with JH-LPH-50
Method: X-RAY DIFFRACTION / Resolution: 1.73 Å

Chemicals

ChemComp-MN:
Unknown entry

ChemComp-BKB:
5-{4-[3-chloro-5-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}-N-[5-(hydroxyamino)-5-oxopentyl]-2,3-dihydro-1H-indole-1-carboxamide

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-HOH:
WATER

ChemComp-BN8:
6-{[(4-{4-[3-chloro-5-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}phenyl)carbamoyl]amino}-N-hydroxyhexanamide

Source
  • klebsiella pneumoniae (bacteria)
KeywordsHYDROLASE/ANTIBIOTIC / LpxH / lipid A / antibiotic / Gram-negative bacteria / HYDROLASE-ANTIBIOTIC complex / LPS

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