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1V2X

TrmH

Experimental procedure
Experimental methodMAD
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL41XU
Synchrotron siteSPring-8
BeamlineBL41XU
Temperature [K]100
Detector technologyCCD
Collection date2002-06-26
DetectorMARRESEARCH
Wavelength(s)0.9
Spacegroup nameC 1 2 1
Unit cell lengths77.601, 44.023, 56.756
Unit cell angles90.00, 120.78, 90.00
Refinement procedure
Resolution34.370 - 1.500
R-factor0.225
Rwork0.225
R-free0.27700
Structure solution methodMAD
RMSD bond length0.014
RMSD bond angle2.000
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareSHARP
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]40.000
High resolution limit [Å]1.5001.500
Number of reflections60955
<I/σ(I)>9.51.6
Completeness [%]91.881.5
Redundancy2.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP8.5293lithium sulfate, Tris-HCl, PEG 4000, pH 8.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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