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2ZA4

Crystal Structural Analysis of Barnase-barstar Complex

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPHOTON FACTORY BEAMLINE BL-6A
Synchrotron sitePhoton Factory
BeamlineBL-6A
Temperature [K]95
Detector technologyCCD
Collection date2006-01-29
DetectorADSC QUANTUM 4
Wavelength(s)0.978
Spacegroup nameC 1 2 1
Unit cell lengths97.388, 110.255, 47.272
Unit cell angles90.00, 114.97, 90.00
Refinement procedure
Resolution43.360 - 1.580
R-factor0.199
Rwork0.199
R-free0.20000
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1brs
RMSD bond length0.005
RMSD bond angle1.200
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareCNS
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.610
High resolution limit [Å]1.5801.580
Rmerge0.0470.246
Number of reflections61328
<I/σ(I)>35.15
Completeness [%]99.390.9
Redundancy3.12.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP729320% PEG 6000, 0.1M HEPES (pH 7.0), 1.0M lithium chloride, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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