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TitleThe Structure of Glycerol Trinitrate Reductase NerA from Agrobacterium radiobacter Reveals the Molecular Reason for Nitro- and Ene-Reductase Activity in OYE Homologues.
Journal, issue, pagesChembiochem, Vol. 14, Page 836-845, Year 2013
Publish dateMar 5, 2013 (structure data deposition date)
AuthorsOberdorfer, G. / Binter, A. / Wallner, S. / Durchschein, K. / Hall, M. / Faber, K. / Macheroux, P. / Gruber, K.
External linksChembiochem / PubMed:23606302
MethodsX-ray diffraction
Resolution1.6 - 2.49 Å
Structure data

PDB-4jic:
Glycerol Trinitrate Reductase NerA from Agrobacterium radiobacter
Method: X-RAY DIFFRACTION / Resolution: 1.6 Å

PDB-4jip:
Crystal structure of glycerol trinitrate reductase NerA from Agrobacterium radiobacter in complex with 4-hydroxybenzaldehyde
Method: X-RAY DIFFRACTION / Resolution: 2.29 Å

PDB-4jiq:
Crystal structure of glycerol trinitrate reductase NerA from Agrobacterium radiobacter in complex with 1-nitro-2-phenylpropene
Method: X-RAY DIFFRACTION / Resolution: 2.49 Å

Chemicals

ChemComp-FMN:
FLAVIN MONONUCLEOTIDE

ChemComp-PEG:
DI(HYDROXYETHYL)ETHER

ChemComp-SO4:
SULFATE ION

ChemComp-HOH:
WATER

ChemComp-HBA:
P-HYDROXYBENZALDEHYDE

ChemComp-1L5:
[(1E)-1-nitroprop-1-en-2-yl]benzene

ChemComp-DMS:
DIMETHYL SULFOXIDE / DMSO, precipitant*YM

Source
  • agrobacterium tumefaciens (bacteria)
KeywordsOXIDOREDUCTASE / TIM-barrel / ene-reductase

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