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8B4C

ToxR bacterial transcriptional regulator bound to 20 bp toxT promoter DNA

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALBA BEAMLINE XALOC
Synchrotron siteALBA
BeamlineXALOC
Temperature [K]100
Detector technologyPIXEL
Collection date2013-10-30
DetectorDECTRIS PILATUS 6M
Wavelength(s)0.9792
Spacegroup nameP 1 21 1
Unit cell lengths36.500, 54.209, 63.657
Unit cell angles90.00, 92.58, 90.00
Refinement procedure
Resolution63.590 - 2.070
R-factor0.18494
Rwork0.182
R-free0.24107
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)PhoB DNA binding domain (1GXP)
RMSD bond length0.013
RMSD bond angle1.729
Data reduction softwareXDS
Data scaling softwareSCALA
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0069)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]63.5902.140
High resolution limit [Å]2.0702.070
Rmerge0.1051.016
Number of reflections146251451
<I/σ(I)>16.32
Completeness [%]99.8
Redundancy7.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP29330% PEG 4000, 0.1 M sodium acetate pH 4, 0.15 M ammonium acetate

219869

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