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2EFO

Crystal structure of Tyr77 to Ala of ST1022 from Sulfolobus tokodaii 7

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL45XU
Synchrotron siteSPring-8
BeamlineBL45XU
Temperature [K]180
Detector technologyCCD
Collection date2006-10-07
DetectorRIGAKU JUPITER 210
Wavelength(s)0.9794
Spacegroup nameI 4 2 2
Unit cell lengths103.902, 103.902, 74.483
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution19.710 - 2.400
R-factor0.229
Rwork0.229
R-free0.26400
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2e7w
RMSD bond length0.007
RMSD bond angle1.300
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareMOLREP
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.280
High resolution limit [Å]2.2002.200
Rmerge0.0920.488
Number of reflections10745
Completeness [%]99.9100
Redundancy14.614.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6.229320% PolypropyleneGlycol, 30% Isopropanol, 0.07M Sodium citrate, 200mM ndSb-221, pH 6.2, VAPOR DIFFUSION, SITTING DROP, temperature 293K

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