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2ROM

CRYSTAL STRUCTURE OF NITRIC REDUCTASE FROM DENITRIFYING FUNGUS FUSARIUM OXYSPORUM COMPLEX WITH CARBON MONOXIDE

Experimental procedure
Source typeSYNCHROTRON
Source detailsPHOTON FACTORY BEAMLINE BL-6A
Synchrotron sitePhoton Factory
BeamlineBL-6A
Temperature [K]283
Detector technologyIMAGE PLATE
Collection date1995-12-10
DetectorFUJI
Spacegroup nameP 21 21 21
Unit cell lengths55.140, 82.820, 87.170
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution10.000 - 2.000
R-factor0.199
Rwork0.199
R-free0.26900
Structure solution methodMIR
RMSD bond length0.007
RMSD bond angle22.700

*

Data reduction softwareDENZO
Data scaling softwareCCP4 ((SCALA)
Phasing softwareMLPHARE
Refinement softwareX-PLOR (3.851)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]100.0002.240
High resolution limit [Å]2.0002.000
Rmerge0.0440.107
Total number of observations77274

*

Number of reflections22706
<I/σ(I)>12.56.9
Completeness [%]80.263.3
Redundancy3.42.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion, sitting drop

*

5.5Park, S.Y., (1997) FEBS Lett. 412, 346.

*

Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11reservoirMES100 (mM)
21reservoirPEG4000
31dropprotein25 (mg/ml)
41dropPEG4000
51dropMES50 (mM)

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