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1WOC

Crystal structure of PriB

Experimental procedure
Experimental methodMAD
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL38B1
Synchrotron siteSPring-8
BeamlineBL38B1
Temperature [K]100
Detector technologyCCD
Collection date2004-04-16
DetectorADSC QUANTUM 4
Wavelength(s)0.97137, 0.9790, 0.9792
Spacegroup nameC 1 2 1
Unit cell lengths103.521, 70.317, 74.805
Unit cell angles90.00, 131.59, 90.00
Refinement procedure
Resolution9.000 - 2.000
Rwork0.221
R-free0.27620
Structure solution methodMAD
RMSD bond length0.009
RMSD bond angle1.521
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareSOLVE
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.070
High resolution limit [Å]2.0002.000
Rmerge0.0620.112
Number of reflections27253
<I/σ(I)>22.6
Completeness [%]100.099.9
Redundancy3.83.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP829825%(v/v) MPD, 50mM Magnesium Chloride, 100mM Tris-HCl, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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