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3OLO

Crystal structure of a PAS domain from two-component sensor histidine kinase

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 19-BM
Synchrotron siteAPS
Beamline19-BM
Temperature [K]100
Detector technologyCCD
Collection date2010-06-30
DetectorADSC QUANTUM 210r
Wavelength(s)0.97926
Spacegroup nameP 41 21 2
Unit cell lengths85.430, 85.430, 67.840
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution30.202 - 2.094
R-factor0.1799
Rwork0.177
R-free0.22680
Structure solution methodSAD
RMSD bond length0.007
RMSD bond angle1.000
Data reduction softwareHKL-3000
Data scaling softwareHKL-3000
Phasing softwareMLPHARE
Refinement softwarePHENIX ((phenix.refine: 1.6.1_357))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]35.0002.140
High resolution limit [Å]2.0942.100
Rmerge0.1380.743
Number of reflections15260
<I/σ(I)>16.62.4
Completeness [%]99.6100
Redundancy6.66.3
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP52970.05 M citric acid, 0.05 M BIS-TRIS propane, 16% (w/v) PEG3350, pH 5.0, VAPOR DIFFUSION, HANGING DROP, temperature 297K

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