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3V5I

The crystal structure of the mutant ClpP S98A (Staphylococcus aureus)

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X06SA
Synchrotron siteSLS
BeamlineX06SA
Temperature [K]100
Detector technologyPIXEL
Collection date2011-11-05
DetectorPSI PILATUS 6M
Wavelength(s)1.0
Spacegroup nameP 1
Unit cell lengths97.550, 109.730, 171.410
Unit cell angles73.10, 78.68, 71.46
Refinement procedure
Resolution24.800 - 2.800
R-factor0.2173
Rwork0.216
R-free0.24151
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3qwd
RMSD bond length0.012
RMSD bond angle1.357
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwareREFMAC (5.6.0119)
Refinement softwareREFMAC (5.6.0119)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]25.0002.900
High resolution limit [Å]2.8002.800
Rmerge0.0910.393
Number of reflections150830
<I/σ(I)>5.551.67
Completeness [%]95.696.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP72930.18 M Magnesium acetate, 0.1 M Sodium cacodylate, 12% MPD, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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