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2EFP

Crystal Structure of Tyr77 to Ala of ST1022-Glutamine Complex from Sulolobus tokodaii 7

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU
Temperature [K]180
Detector technologyIMAGE PLATE
Collection date2007-02-08
DetectorRIGAKU RAXIS VII
Spacegroup nameI 4 2 2
Unit cell lengths103.687, 103.687, 74.942
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution19.990 - 2.200
R-factor0.232
Rwork0.232
R-free0.25800
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
Rmerge0.0500.455
Number of reflections10689
Completeness [%]99.6100
Redundancy9.19.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6.229320% PolypropyleneGlycol, 30% Isopropanol, 0.07M Sodium Citrate, 10mM Taurine, pH 6.2, VAPOR DIFFUSION, SITTING DROP, temperature 293K

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