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TitleTricyclic 1,5-naphthyridinone oxabicyclooctane-linked novel bacterial topoisomerase inhibitors as broad-spectrum antibacterial agents-SAR of left-hand-side moiety (Part-2).
Journal, issue, pagesBioorg. Med. Chem. Lett., Vol. 25, Page 1831-1835, Year 2015
Publish dateJun 1, 2015 (structure data deposition date)
AuthorsSingh, S.B. / Kaelin, D.E. / Wu, J. / Miesel, L. / Tan, C.M. / Black, T. / Nargund, R. / Meinke, P.T. / Olsen, D.B. / Lagrutta, A. ...Singh, S.B. / Kaelin, D.E. / Wu, J. / Miesel, L. / Tan, C.M. / Black, T. / Nargund, R. / Meinke, P.T. / Olsen, D.B. / Lagrutta, A. / Lu, J. / Patel, S. / Rickert, K.W. / Smith, R.F. / Soisson, S. / Sherer, E. / Joyce, L.A. / Wei, C. / Peng, X. / Wang, X. / Fukuda, H. / Kishii, R. / Takei, M. / Takano, H. / Shibasaki, M. / Yajima, M. / Nishimura, A. / Shibata, T. / Fukuda, Y.
External linksBioorg. Med. Chem. Lett. / PubMed:25851938
MethodsX-ray diffraction
Resolution2.65 Å
Structure data

PDB-5bs3:
Crystal Structure of S.A. gyrase in complex with Compound 7
Method: X-RAY DIFFRACTION / Resolution: 2.65 Å

Chemicals

ChemComp-MN:
Unknown entry

ChemComp-SO4:
SULFATE ION

ChemComp-WCP:
(4R)-3-fluoro-4-hydroxy-4-{[(1r,4R)-4-{[(3-oxo-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazin-6-yl)methyl]amino}-2-oxabicyclo[2.2.2]oct-1-yl]methyl}-4,5-dihydro-7H-pyrrolo[3,2,1-de][1,5]naphthyridin-7-one

ChemComp-HOH:
WATER

Source
  • staphylococcus aureus (bacteria)
  • staphylococcus aureus subsp. aureus ed98 (bacteria)
KeywordsIsomerase/DNA/RNA / gyrase / antibacterial / SAR / complex / Isomerase-DNA-RNA complex

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