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Structure paper

TitleNear-Atomic Resolution Neutron Crystallography on Perdeuterated Pyrococcus Furiosus Rubredoxin: Implication of Hydronium Ions and Protonation State Equilibria in Redox Changes.
Journal, issue, pagesAngew. Chem. Int. Ed. Engl., Vol. 52, Page 1022-, Year 2013
Publish dateApr 20, 2012 (structure data deposition date)
AuthorsCuypers, M.G. / Mason, S.A. / Blakeley, M.P. / Mitchell, E.P. / Haertlein, M. / Forsyth, V.T.
External linksAngew. Chem. Int. Ed. Engl. / PubMed:23225503
Methodsneutron diffraction / X-ray diffraction
Resolution0.92 - 1.381 Å
Structure data

PDB-4ar3:
Near-atomic resolution neutron crystallography on the oxidised form perdeuterated Pyrococcus furiosus rubredoxin.
Method: NEUTRON DIFFRACTION / Resolution: 1.05 Å

PDB-4ar4:
Neutron crystallographic structure of the reduced form perdeuterated Pyrococcus furiosus rubredoxin to 1.38 Angstrom resolution.
Method: NEUTRON DIFFRACTION / Resolution: 1.381 Å

PDB-4ar5:
X-ray crystallographic structure of the oxidised form perdeuterated Pyrococcus furiosus rubredoxin in D2O at 295K (in quartz capillary) to 1.00 Angstrom resolution.
Method: X-RAY DIFFRACTION / Resolution: 1 Å

PDB-4ar6:
X-ray crystallographic structure of the reduced form perdeuterated Pyrococcus furiosus rubredoxin at 295 K (in quartz capillary) to 0.92 Angstroms resolution.
Method: X-RAY DIFFRACTION / Resolution: 0.92 Å

Chemicals

ChemComp-FE:
Unknown entry

ChemComp-D8U:
Unknown entry

ChemComp-D3O:
trideuteriooxidanium

ChemComp-DOD:
DEUTERATED WATER

Source
  • pyrococcus furiosus (strain atcc 43587 / dsm 3638 / jcm 8422 / vc1) (archaea)
  • pyrococcus furiosus (archaea)
KeywordsELECTRON TRANSPORT / PERDEUTERATED / MONOCHROMATIC NEUTRON CRYSTALLOGRAPHY / HYDRONIUM / PROTONATION STATE / AMBIENT CAPILLARY

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