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4NSC

Crystal Structure of CBARA1 in the Apo-form

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRF BEAMLINE BL17U
Synchrotron siteSSRF
BeamlineBL17U
Temperature [K]100
Detector technologyCCD
Collection date2011-09-25
DetectorMARMOSAIC 225 mm CCD
Wavelength(s)0.9791
Spacegroup nameP 1 21 1
Unit cell lengths90.879, 146.819, 115.872
Unit cell angles90.00, 111.08, 90.00
Refinement procedure
Resolution36.720 - 3.200
R-factor0.254
Rwork0.254
R-free0.30700
Structure solution methodSAD
RMSD bond length0.010
RMSD bond angle1.500
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHENIX (1.7)
Refinement softwareCNS (1.2)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0003.400
High resolution limit [Å]3.2003.200
Number of reflections44146
Completeness [%]94.669
Redundancy6.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP72938% PEG 3350 and 0.075 M ammonium citrate tribasic pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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