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4Q69

Crystal structure of a SusD homolog (BT2259) from Bacteroides thetaiotaomicron VPI-5482 at 2.50 A resolution

Experimental procedure
Experimental methodMAD
Source typeSYNCHROTRON
Source detailsSSRL BEAMLINE BL9-2
Synchrotron siteSSRL
BeamlineBL9-2
Temperature [K]100
Detector technologyCCD
Collection date2014-02-13
DetectorMARMOSAIC 325 mm CCD
Wavelength(s)0.95369,0.97936,0.97918
Spacegroup nameP 31 2 1
Unit cell lengths135.124, 135.124, 139.567
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution89.672 - 2.500
R-factor0.1733
Rwork0.172
R-free0.19890
Structure solution methodMAD
RMSD bond length0.005
RMSD bond angle0.998
Data reduction softwareMOSFLM
Data scaling softwareSCALA (3.3.20)
Phasing softwareSHELX
Refinement softwareREFMAC (5.7.0032)
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]89.67289.6722.560
High resolution limit [Å]2.50011.1802.500
Rmerge0.0100.010
Total number of observations350523643
Number of reflections51369
<I/σ(I)>920.91.9
Completeness [%]100.098.1100
Redundancy6.25.46.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6.52770.1M sodium citrate pH 6.5, NANODROP, VAPOR DIFFUSION, SITTING DROP, temperature 277K

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