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2DQ0

Crystal structure of seryl-tRNA synthetase from Pyrococcus horikoshii complexed with a seryl-adenylate analog

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL41XU
Synchrotron siteSPring-8
BeamlineBL41XU
Temperature [K]100
Detector technologyCCD
Collection date2005-06-29
DetectorADSC QUANTUM 315
Wavelength(s)1
Spacegroup nameP 21 21 21
Unit cell lengths96.038, 120.037, 126.508
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution48.350 - 2.600
R-factor0.192
Rwork0.192
R-free0.24800
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1set
RMSD bond length0.010
RMSD bond angle1.600
Data scaling softwareHKL-2000
Phasing softwareMOLREP
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.690
High resolution limit [Å]2.6002.600
Rmerge0.0740.602
Number of reflections45769
<I/σ(I)>33.13.2
Completeness [%]100.0100
Redundancy7.37.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP7.52931.6M ammonium sulfate, 0.1M magnesium acetate, 0.1M hepes-NaOH, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K

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