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3SO1

Crystal structure of a double mutant T41S T82S of a betagamma-crystallin domain from Clostridium beijerinckii

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU FR-E+ SUPERBRIGHT
Temperature [K]93
Detector technologyIMAGE PLATE
Collection date2010-09-10
DetectorRIGAKU RAXIS IV
Wavelength(s)1.5418
Spacegroup nameP 21 21 21
Unit cell lengths67.582, 103.650, 105.671
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution50.000 - 1.850
R-factor0.21678
Rwork0.215
R-free0.24626
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3i9h
RMSD bond length0.006
RMSD bond angle0.895
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareMOLREP
Refinement softwareREFMAC (5.5.0102)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.920
High resolution limit [Å]1.8501.850
Number of reflections63524
<I/σ(I)>24.53.2
Redundancy76.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP27725-30% PEG 3350, 0.1M HEPES, 0.1-0.2M lithium sulphate, pH 7.0-7.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K

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