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4TRG

the SNL domain of SidC

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsCHESS BEAMLINE A1
Synchrotron siteCHESS
BeamlineA1
Temperature [K]100
Detector technologyCCD
Collection date2012-06-20
DetectorADSC QUANTUM 210
Wavelength(s)0.979
Spacegroup nameP 21 21 21
Unit cell lengths61.533, 133.438, 170.249
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution36.000 - 2.590
R-factor0.19083
Rwork0.189
R-free0.23104
Structure solution methodSAD
RMSD bond length0.016
RMSD bond angle1.637
Data scaling softwareHKL-2000
Phasing softwareSHELX
Refinement softwareREFMAC (5.7.0032)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]36.0002.660
High resolution limit [Å]2.5902.600
Rmerge0.180
Number of reflections44061
<I/σ(I)>31.110.9
Completeness [%]99.999.8
Redundancy7.87.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.62980.1 M cacodylate pH 5.6, 7.5% PEG6000, and 10 mM DTT

223790

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