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2FF4

Mycobacterium tuberculosis EmbR in complex with low affinity phosphopeptide

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID29
Synchrotron siteESRF
BeamlineID29
Temperature [K]100
Detector technologyCCD
Collection date2005-07-15
DetectorADSC QUANTUM 210
Wavelength(s)0.9794
Spacegroup nameC 1 2 1
Unit cell lengths162.390, 82.040, 81.080
Unit cell angles90.00, 115.37, 90.00
Refinement procedure
Resolution46.000 - 1.900
R-factor0.21644
Rwork0.215
R-free0.23941
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.008
RMSD bond angle1.132
Data reduction softwareXDS
Data scaling softwareXDS
Phasing softwarePHASER
Refinement softwareREFMAC (5.2.0005)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]46.6002.000
High resolution limit [Å]1.9001.900
Rmerge0.0730.294
Number of reflections75792
<I/σ(I)>155
Completeness [%]100.0100
Redundancy4.24.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8.52950.1 M Tris-HCl, 2.5% PEG 8000, 3% ethylene glycol, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 295K

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