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2E6B

Crystal structure of the stationary phase survival protein SurE from Thermus thermophilus HB8 in complex with magnesium and tungstate

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL44B2
Synchrotron siteSPring-8
BeamlineBL44B2
Temperature [K]90
Detector technologyCCD
Collection date2005-05-20
DetectorADSC QUANTUM 210
Wavelength(s)1.0
Spacegroup nameP 31 2 1
Unit cell lengths132.018, 132.018, 130.824
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution46.460 - 2.500
R-factor0.198
Rwork0.198
R-free0.23000
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2e69
RMSD bond length0.005
RMSD bond angle1.400
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareMOLREP
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.590
High resolution limit [Å]2.5002.500
Rmerge0.0690.318
Number of reflections46054
<I/σ(I)>15.69
Completeness [%]100.0100
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION8.52930.1M Tris-HCl pH8.5, 0.75M ammonium sulfate, 10% glycerol, VAPOR DIFFUSION, temperature 293K

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