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5DAU

Crystal structure of Staphylococcal nuclease variant Delta+PHS V39E/V104E at cryogenic temperature

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSEALED TUBE
Source detailsOTHER
Temperature [K]110
Detector technologyCCD
Collection date2015-07-16
DetectorAGILENT ATLAS CCD
Wavelength(s)1.5418
Spacegroup nameP 1 21 1
Unit cell lengths31.178, 60.353, 38.425
Unit cell angles90.00, 93.52, 90.00
Refinement procedure
Resolution38.350 - 1.500
R-factor0.1603
Rwork0.159
R-free0.19000
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3bdc
RMSD bond length0.015
RMSD bond angle1.570
Data reduction softwareCrysalisPro (1.171.36.32)
Data scaling softwareCrysalisPro (1.171.36.32)
Phasing softwarePHASER (2.5.2)
Refinement softwareREFMAC (5.8.0103)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.550
High resolution limit [Å]1.5001.500
Rmerge0.0150.131
Number of reflections22818
<I/σ(I)>52.296.64
Completeness [%]100.0100
Redundancy10.17.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP727722% MPD, 25 mM potassium phosphate, calcium chloride, pdTp

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