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5IHW

The crystal structure of SdrE from staphylococcus aureus

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRF BEAMLINE BL17U
Synchrotron siteSSRF
BeamlineBL17U
Temperature [K]173
Detector technologyCCD
Collection date2013-04-11
DetectorMARRESEARCH
Wavelength(s)0.9782
Spacegroup nameP 1
Unit cell lengths39.260, 41.560, 51.140
Unit cell angles95.59, 97.55, 99.55
Refinement procedure
Resolution50.320 - 1.250
R-factor0.1444
Rwork0.143
R-free0.17640
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)5cf3
RMSD bond length0.025
RMSD bond angle2.263
Data reduction softwareiMOSFLM
Data scaling softwareSCALEPACK
Phasing softwarePHENIX
Refinement softwareREFMAC (5.8.0073)
Data quality characteristics
 Overall
Low resolution limit [Å]50.320
High resolution limit [Å]1.250
Rmerge0.056
Number of reflections75580
<I/σ(I)>8.1
Completeness [%]87.0
Redundancy3.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP2930.2mol/L CaCl2, 35% PEG 3350, 0.1mol/L, Bis-Tris pH 6.6

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