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4EUK

Crystal structure

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X06DA
Synchrotron siteSLS
BeamlineX06DA
Temperature [K]100
Detector technologyCCD
Collection date2011-02-19
DetectorMARMOSAIC 225 mm CCD
Wavelength(s)1.0000
Spacegroup nameP 21 3
Unit cell lengths106.800, 106.800, 106.800
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution47.760 - 1.950
R-factor0.17342
Rwork0.172
R-free0.19683
Structure solution methodSIRAS
RMSD bond length0.013
RMSD bond angle1.248
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwareautoSHARP
Refinement softwareREFMAC (5.5.0109)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]47.7602.000
High resolution limit [Å]1.9501.950
Rmerge0.0510.413
Number of reflections29820
<I/σ(I)>23.33.9
Completeness [%]99.999.4
Redundancy13.411.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6.529320% PEG 550 MME, 10% PEG 20000, 0.1M MES/imidazole, 0.02M 1,6-hexanediol, 0.02M 1-butanol, 0.02M (R,S)-1,2-propandiol, 0.02M 2-propanol, 0.02M 1,3-propandiol, 0.02M 1,4-butandiol , pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K

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