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3D6V

Crystal structure of 4-(trifluoromethyldiazirinyl)phenylalanyl-tRNA synthetase

Replaces:  2Q1I
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 5.0.3
Synchrotron siteALS
Beamline5.0.3
Temperature [K]100
Detector technologyCCD
Collection date2007-02-26
DetectorADSC QUANTUM 4
Wavelength(s)1.0
Spacegroup nameP 43 21 2
Unit cell lengths104.155, 104.155, 70.826
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution38.920 - 2.200
R-factor0.19689
Rwork0.193
R-free0.26959
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.028
RMSD bond angle2.278
Data reduction softwareHKL-2000
Data scaling softwareSCALA
Phasing softwareAMoRE
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.258
High resolution limit [Å]2.2002.200
Number of reflections18987
Completeness [%]98.684.09
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.52935% PEG8K, 10-20% PEG300, 9% glycerol, 100 mM Tris-HCl, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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