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3LHH

The crystal structure of CBS domain protein from Shewanella oneidensis MR-1.

Experimental procedure
Experimental methodMAD
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 19-ID
Synchrotron siteAPS
Beamline19-ID
Temperature [K]100
Detector technologyCCD
Collection date2009-12-02
DetectorADSC QUANTUM 315r
Wavelength(s)0.97937
Spacegroup nameP 21 21 21
Unit cell lengths38.605, 55.257, 78.822
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution27.578 - 2.100
R-factor0.2031
Rwork0.200
R-free0.26530
Structure solution methodMAD
RMSD bond length0.008
RMSD bond angle1.174
Data reduction softwareHKL-3000
Data scaling softwareHKL-3000
Phasing softwareSHELXD
Refinement softwarePHENIX ((phenix.refine: 1.5_2))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]27.6002.140
High resolution limit [Å]2.1002.100
Rmerge0.1010.797
Number of reflections10353
<I/σ(I)>28.11.52
Completeness [%]99.598.3
Redundancy8.27.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.62930.1M Tri-Na-Citrate, 2% MPD, 25% PEG3350, pH 5.6, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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