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3DHZ

Apo (iron free) structure of C. ammoniagenes R2 protein

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsMAX II BEAMLINE I711
Synchrotron siteMAX II
BeamlineI711
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2001-02-03
DetectorMARRESEARCH
Wavelength(s)0.98
Spacegroup nameP 1 21 1
Unit cell lengths48.908, 86.537, 70.610
Unit cell angles90.00, 105.48, 90.00
Refinement procedure
Resolution20.000 - 1.630
R-factor0.168
Rwork0.165
R-free0.22200
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.018
RMSD bond angle1.760
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0001.690
High resolution limit [Å]1.6301.630
Rmerge0.204
Number of reflections67077
Completeness [%]94.786.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.529830% w/v PEG 4000, 100 mM sodium citrate, 200 mM Ammonium Acetate, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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