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5KSR

Stationary phase survival protein E (SurE) from Xylella fastidiosa - XFSurE-TB (Tetramer Bigger).

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsLNLS BEAMLINE W01B-MX2
Synchrotron siteLNLS
BeamlineW01B-MX2
Temperature [K]100
Detector technologyCCD
Collection date2008-07-15
DetectorMARMOSAIC 225 mm CCD
Wavelength(s)1.459
Spacegroup nameC 1 2 1
Unit cell lengths172.336, 84.170, 87.310
Unit cell angles90.00, 96.62, 90.00
Refinement procedure
Resolution43.248 - 1.960
R-factor0.1985
Rwork0.196
R-free0.23760
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3ty2
RMSD bond length0.018
RMSD bond angle1.524
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwarePHASER (2.3.0)
Refinement softwarePHENIX (1.8.2_1309)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]43.2482.020
High resolution limit [Å]1.9601.960
Rmerge0.0490.338
Number of reflections88536
<I/σ(I)>17.274.8
Completeness [%]99.595.7
Redundancy4.774.34
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP2930.1 M bis-tris propane pH 7.5, 0.14 M Sodium iodide, 20% (W/V) PEG 3350, 5 mM dithiotheitol and 0.1 manganese II chloride.

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