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3OXE

crystal structure of glycine riboswitch, Mn2+ soaked

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSLS BEAMLINE X29A
Synchrotron siteNSLS
BeamlineX29A
Temperature [K]100
Detector technologyCCD
Collection date2009-06-29
DetectorADSC QUANTUM 315
Wavelength(s)1.5000
Spacegroup nameP 32 2 1
Unit cell lengths83.708, 83.708, 198.958
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution20.000 - 2.899
R-factor0.20175
Rwork0.201
R-free0.21902
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3owi
RMSD bond length0.005
RMSD bond angle1.011
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareREFMAC
Refinement softwareREFMAC
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0003.000
High resolution limit [Å]2.8992.899
Rmerge0.0600.564
Number of reflections18565
<I/σ(I)>31.33
Completeness [%]99.9
Redundancy5.35.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.1293.150.05 M Na-cacodylate, pH 5.1, 0.2 M KCl, 8 % (w/v) PEG8000 and 80 mM magnesium acetate, VAPOR DIFFUSION, HANGING DROP, temperature 293.15K

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