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3OEO

The crystal structure E. coli Spy

Experimental procedure
Experimental methodMAD
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 8.3.1
Synchrotron siteALS
Beamline8.3.1
Temperature [K]100
Detector technologyCCD
Collection date2009-08-26
DetectorADSC QUANTUM 315r
Wavelength(s)1.11587, 0.97944, 0.97976, 0.98771, 0.97220
Spacegroup nameP 32
Unit cell lengths69.195, 69.195, 126.347
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution20.000 - 2.700
R-factor0.25462
Rwork0.252
R-free0.29973
Structure solution methodMAD
RMSD bond length0.007
RMSD bond angle1.116
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareSOLVE
Refinement softwareREFMAC
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]20.00020.0002.800
High resolution limit [Å]2.7005.7702.700
Rmerge0.0540.0300.385
Number of reflections18354
<I/σ(I)>15.1
Completeness [%]98.399.695.3
Redundancy4.15.42.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1EVAPORATION4.62950.1 M acetate pH 4.6, 26-32% (w/v) PEG400, 0.2 M CdCl2, and 2 mM TCEP, EVAPORATION, temperature 295K

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