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3NCO

Crystal structure of FnCel5A from F. nodosum Rt17-B1

Experimental procedure
Experimental methodMAD
Source typeSYNCHROTRON
Source detailsPHOTON FACTORY BEAMLINE BL-5A
Synchrotron sitePhoton Factory
BeamlineBL-5A
Temperature [K]100
Detector technologyCCD
Collection date2008-10-25
DetectorADSC QUANTUM 315
Wavelength(s)0.9798, 0.9795, 0.9600
Spacegroup nameP 21 21 21
Unit cell lengths81.966, 85.769, 107.443
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution50.000 - 1.500
R-factor0.22334
Rwork0.221
R-free0.26344
Structure solution methodMAD
RMSD bond length0.019
RMSD bond angle1.725
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareSHELX
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.750
High resolution limit [Å]1.5001.670
Rmerge0.0720.407
Number of reflections121477
Completeness [%]99.099
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP290VAPOR DIFFUSION, HANGING DROP, temperature 290K

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