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9CIJ

Crystal structure of Staphylococcal nuclease variant Delta+PHS V23E/L36R at cryogenic temperature

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSEALED TUBE
Source detailsAgilent SuperNova
Temperature [K]110
Detector technologyCCD
Collection date2021-11-20
DetectorAGILENT ATLAS CCD
Wavelength(s)1.5418
Spacegroup nameP 1 21 1
Unit cell lengths31.031, 60.384, 38.303
Unit cell angles90.00, 93.97, 90.00
Refinement procedure
Resolution24.900 - 1.900
R-factor0.16706
Rwork0.165
R-free0.20105
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.009
RMSD bond angle1.655
Data reduction softwareCrysalisPro (41.93a 64-bit (release 15-12-2020))
Data scaling softwareCrysalisPro (41.93a 64-bit (release 15-12-2020))
Phasing softwarePHASER (2.8.3)
Refinement softwareREFMAC (5.8.0425)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]24.9001.970
High resolution limit [Å]1.9001.900
Rmerge0.0220.163
Number of reflections112161127
<I/σ(I)>405.04
Completeness [%]99.9100
Redundancy105.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP927735% MPD, 25mM Potassium Phosphate

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