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2W7S

SplA serine protease of Staphylococcus aureus (1.8A)

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X10SA
Synchrotron siteSLS
BeamlineX10SA
Temperature [K]100
Detector technologyCCD
Collection date2008-11-17
DetectorMARRESEARCH
Spacegroup nameP 21 21 21
Unit cell lengths72.623, 81.427, 132.023
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution19.850 - 1.800
R-factor0.214
Rwork0.213
R-free0.24400
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2as9
RMSD bond length0.007
RMSD bond angle1.015
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwarePHASER
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0001.900
High resolution limit [Å]1.8001.800
Rmerge0.0600.220
Number of reflections72964
<I/σ(I)>19.66.5
Completeness [%]99.6100
Redundancy5.35.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
10.1M HEPES PH 7.5, 0.2M (NH4)2SO4, 30% PEG 6000

246031

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