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2OX6

Crystal structure of gene product SO3848 from Shewanella oneidensis MR-1

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 19-ID
Synchrotron siteAPS
Beamline19-ID
Temperature [K]100
Detector technologyCCD
Collection date2005-06-26
DetectorADSC QUANTUM 315
Wavelength(s)0.97980
Spacegroup nameP 21 21 21
Unit cell lengths69.068, 88.680, 117.527
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution70.710 - 1.700
R-factor0.20105
Rwork0.199
R-free0.23930
Structure solution methodSAD
RMSD bond length0.010
RMSD bond angle1.193
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareSHELXS
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]70.7101.746
High resolution limit [Å]1.7001.700
Rmerge0.0620.581
Number of reflections71755
<I/σ(I)>26.251.2
Completeness [%]94.756.42
Redundancy4.62.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP5.52981.0M (NH4)2SO4, 0.1M Bis-Tris pH 5.5, 1% PEG3350, VAPOR DIFFUSION, SITTING DROP, temperature 298K

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