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Structure paper

TitleHigh Affinity InhA Inhibitors with Activity against Drug-Resistant Strains of Mycobacterium tuberculosis
Journal, issue, pagesACS Chem. Biol., Vol. 1, Page 43-53, Year 2006
Publish dateSep 19, 2005 (structure data deposition date)
AuthorsSullivan, T.J. / Truglio, J.J. / Boyne, M.E. / Novichenok, P. / Zhang, X. / Stratton, C. / Li, H.J. / Kaur, T. / Amin, A. / Johnson, F. ...Sullivan, T.J. / Truglio, J.J. / Boyne, M.E. / Novichenok, P. / Zhang, X. / Stratton, C. / Li, H.J. / Kaur, T. / Amin, A. / Johnson, F. / Slayden, R.A. / Kisker, C. / Tonge, P.J.
External linksSearch PubMed
MethodsX-ray diffraction
Resolution2.3 - 2.8 Å
Structure data

PDB-2b35:
Crystal structure of Mycobacterium tuberculosis enoyl reductase (InhA) inhibited by triclosan
Method: X-RAY DIFFRACTION / Resolution: 2.3 Å

PDB-2b36:
Crystal structure of Mycobacterium tuberculosis enoyl reductase (InhA) inhibited by 5-pentyl-2-phenoxyphenol
Method: X-RAY DIFFRACTION / Resolution: 2.8 Å

PDB-2b37:
Crystal structure of Mycobacterium tuberculosis enoyl reductase (InhA) inhibited by 5-octyl-2-phenoxyphenol
Method: X-RAY DIFFRACTION / Resolution: 2.6 Å

Chemicals

ChemComp-TCL:
TRICLOSAN / antifungal, antibiotic, detergent*YM

ChemComp-NAD:
NICOTINAMIDE-ADENINE-DINUCLEOTIDE / NAD*YM

ChemComp-5PP:
5-PENTYL-2-PHENOXYPHENOL

ChemComp-8PS:
5-OCTYL-2-PHENOXYPHENOL

ChemComp-HOH:
WATER

Source
  • mycobacterium tuberculosis (bacteria)
KeywordsOXIDOREDUCTASE / enoyl reductase

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