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2E6X

X-ray structure of TT1592 from Thermus thermophilus HB8

Experimental procedure
Experimental methodMAD
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL26B1
Synchrotron siteSPring-8
BeamlineBL26B1
Temperature [K]100
Detector technologyCCD
Collection date2004-03-11
DetectorRIGAKU JUPITER 210
Wavelength(s)0.9, 0.97910, 0.97941
Spacegroup nameC 1 2 1
Unit cell lengths96.486, 56.051, 48.885
Unit cell angles90.00, 93.48, 90.00
Refinement procedure
Resolution35.360 - 2.000
R-factor0.214
Rwork0.214
R-free0.25300
Structure solution methodMAD
RMSD bond length0.013
RMSD bond angle1.600
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareSOLVE
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]35.3602.070
High resolution limit [Å]2.0002.000
Rmerge0.0610.192
Number of reflections17159
<I/σ(I)>13.73.86
Completeness [%]97.496.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP4.62980.6M potassium thiocyanate, 0.1M sodium acetate, pH 4.6, VAPOR DIFFUSION, HANGING DROP, temperature 298.0K

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