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4RKN

Wolinella succinogenes octaheme sulfite reductase MccA, form II

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X06SA
Synchrotron siteSLS
BeamlineX06SA
Detector technologyPIXEL
Collection date2012-10-24
DetectorDECTRIS PILATUS 6M
Wavelength(s)1.7389
Spacegroup nameH 3
Unit cell lengths186.472, 186.472, 232.836
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution47.260 - 2.100
R-factor0.13666
Rwork0.135
R-free0.17517
Structure solution methodSAD
RMSD bond length0.018
RMSD bond angle1.921
Data reduction softwareXDS
Data scaling softwareSCALA
Phasing softwareSHARP
Refinement softwareREFMAC (5.7.0032)
Data quality characteristics
 Overall
Low resolution limit [Å]47.260
High resolution limit [Å]2.100
Rmerge0.102
Number of reflections175765
<I/σ(I)>17.3
Completeness [%]99.8
Redundancy9.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP9.529815% PEG 3350, 0.1 M CHES/NaOH, pH 9.5, VAPOR DIFFUSION, SITTING DROP, temperature 298K

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