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5BPG

Crystal structure of the water-soluble FraC purified starting from the trans-membrane pore

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPHOTON FACTORY BEAMLINE BL-5A
Synchrotron sitePhoton Factory
BeamlineBL-5A
Temperature [K]100
Detector technologyCCD
Collection date2014-11-04
DetectorADSC QUANTUM 315
Wavelength(s)1.000
Spacegroup nameP 1 21 1
Unit cell lengths77.300, 44.440, 114.950
Unit cell angles90.00, 92.82, 90.00
Refinement procedure
Resolution47.190 - 2.140
R-factor0.21269
Rwork0.210
R-free0.26286
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3vwi
RMSD bond length0.012
RMSD bond angle1.475
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwareAimless
Refinement softwareREFMAC (5.8.0073)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]47.1902.210
High resolution limit [Å]2.1402.140
Rmerge0.0990.310
Number of reflections42232
<I/σ(I)>9.73.4
Completeness [%]97.589.3
Redundancy4.53.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8.5293Microseeds generated in: 24% PEG 4000, 200 mM ammonium sulfate, 100 mM Cacodylate (pH 7.4) Single crystals generated in: 8% PEG 4000, 100 mM TRIS-HCl

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