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3ERO

Crystal structure of Staphylococcal nuclease variant Delta+PHS I72E at cryogenic temperature

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSEALED TUBE
Source detailsOTHER
Temperature [K]110
Detector technologyCCD
Collection date2008-01-31
DetectorAPEX II CCD
Wavelength(s)1.5418
Spacegroup nameP 1 21 1
Unit cell lengths31.146, 60.423, 38.117
Unit cell angles90.00, 93.45, 90.00
Refinement procedure
Resolution27.650 - 1.850
R-factor0.189
Rwork0.185
R-free0.22600
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1TQO.pdb
RMSD bond length0.012
RMSD bond angle1.419
Data reduction softwareSAINT
Data scaling softwareSAINT
Phasing softwarePHASER
Refinement softwareREFMAC
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]60.4201.940
High resolution limit [Å]1.8501.850
Rmerge0.0550.254
Number of reflections12137
<I/σ(I)>29.235.17
Completeness [%]100.0100
Redundancy11.945.05
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP927720% MPD, 25 mM Potassium Phosphate, Calcium Chloride, pdTp, Soaked in higher % MPD before freezing, pH 9.0, VAPOR DIFFUSION, HANGING DROP, temperature 277K

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