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4ZUZ

SidC 1-871

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsCHESS BEAMLINE A1
Synchrotron siteCHESS
BeamlineA1
Temperature [K]100
Detector technologyCCD
Collection date2013-06-30
DetectorADSC QUANTUM 210
Wavelength(s)0.9759
Spacegroup nameC 1 2 1
Unit cell lengths228.159, 83.934, 129.405
Unit cell angles90.00, 108.82, 90.00
Refinement procedure
Resolution49.160 - 2.860
R-factor0.2274
Rwork0.225
R-free0.28150
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4irh
RMSD bond length0.010
RMSD bond angle1.475
Data scaling softwareHKL-2000
Refinement softwareREFMAC (5.7.0029)
Data quality characteristics
 Overall
Low resolution limit [Å]50.000
High resolution limit [Å]2.860
Number of reflections53345
<I/σ(I)>46.5
Completeness [%]100.0
Redundancy5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.5298PEG 8000, Hepes, NaCl

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