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Structure paper

TitleThe Nitro Group as a Masked Electrophile in Covalent Enzyme Inhibition.
Journal, issue, pagesACS Chem. Biol., Vol. 13, Page 1470-1473, Year 2018
Publish dateJan 11, 2018 (structure data deposition date)
AuthorsRay, S. / Kreitler, D.F. / Gulick, A.M. / Murkin, A.S.
External linksACS Chem. Biol. / PubMed:29782144
MethodsX-ray diffraction
Resolution1.8 - 2.2 Å
Structure data

PDB-6c4a:
Crystal structure of 3-nitropropionate modified isocitrate lyase from Mycobacterium tuberculosis with pyruvate
Method: X-RAY DIFFRACTION / Resolution: 1.8 Å

PDB-6c4c:
Crystal structure of 3-nitropropionate modified isocitrate lyase from Mycobacterium tuberculosis with glyoxylate and pyruvate
Method: X-RAY DIFFRACTION / Resolution: 2.2 Å

Chemicals

ChemComp-PYR:
PYRUVIC ACID

ChemComp-MG:
Unknown entry

ChemComp-3NP:
3-NITROPROPANOIC ACID / inhibitor, agonist, toxin*YM

ChemComp-PEG:
DI(HYDROXYETHYL)ETHER

ChemComp-EPE:
4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID / pH buffer*YM

ChemComp-HOH:
WATER

ChemComp-GLV:
GLYOXYLIC ACID

Source
  • mycobacterium tuberculosis (strain atcc 35801 / tmc 107 / erdman) (bacteria)
KeywordsLYASE

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