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4DBL

Crystal structure of E159Q mutant of BtuCDF

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X06SA
Synchrotron siteSLS
BeamlineX06SA
Temperature [K]90
Detector technologyCCD
Collection date2010-11-12
DetectorMARMOSAIC 225 mm CCD
Wavelength(s)1
Spacegroup nameP 1 21 1
Unit cell lengths133.650, 166.930, 132.820
Unit cell angles90.00, 119.76, 90.00
Refinement procedure
Resolution30.015 - 3.493
R-factor0.2153
Rwork0.214
R-free0.25130
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.004
RMSD bond angle0.784
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwarePHENIX (1.7.2_869)
Refinement softwarePHENIX ((phenix.refine: 1.7.2_869))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0003.580
High resolution limit [Å]3.5003.500
Number of reflections59380
<I/σ(I)>1.957
Completeness [%]93.188.2
Redundancy4.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP5.42930.1M sodium citrate, pH 5.4, 0.3-0.4M ammonium sulphate, 30-35% PEG-400, VAPOR DIFFUSION, SITTING DROP, temperature 293K

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