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3HQ2

BsuCP Crystal Structure

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRL BEAMLINE BL1-5
Synchrotron siteSSRL
BeamlineBL1-5
Temperature [K]100
Detector technologyCCD
Collection date2003-08-25
DetectorADSC QUANTUM 4
Wavelength(s)1.2834
Spacegroup nameI 2 2 2
Unit cell lengths88.957, 149.002, 217.840
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution43.370 - 2.900
R-factor0.1879
Rwork0.188
R-free0.25100
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond angle1.400
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]43.3703.080
High resolution limit [Å]2.9002.900
Rmerge0.1880.302
Number of reflections31847
Completeness [%]96.692.5
Redundancy4.88
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8277.150.2 M NH4F, 32% PEG 3350, pH 8.0, VAPOR DIFFUSION, HANGING DROP, temperature 277.15K

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