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4GLH

DNA dodecamer containing 5-hydroxymethyl cytosine

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X06DA
Synchrotron siteSLS
BeamlineX06DA
Temperature [K]100
Detector technologyPIXEL
Collection date2012-06-09
DetectorDECTRIS PILATUS 2M-F
Wavelength(s)1.00067
Spacegroup nameP 21 21 21
Unit cell lengths25.637, 41.767, 63.997
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution41.780 - 1.662
R-factor0.237
R-free0.27600
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1dpn
RMSD bond length0.009
RMSD bond angle0.029
Data reduction softwareXDS
Data scaling softwareXDS
Phasing softwarePHASER
Refinement softwareSHELXL-97
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]41.7801.760
High resolution limit [Å]1.6621.662
Rmerge0.0250.202
Number of reflections7781
<I/σ(I)>28.666.93
Completeness [%]99.499
Redundancy3.613.71
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP72980.04M sodium cacodylate buffer, 0.08M potassium chloride, 0.012M sodium chloride, 0.012M spermine tetra hydrochloride, 37% MPD, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 298.0K

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