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2E1U

Crystal structure of Dendranthema morifolium DmAT

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPHOTON FACTORY BEAMLINE BL-5A
Synchrotron sitePhoton Factory
BeamlineBL-5A
Temperature [K]90
Detector technologyCCD
Collection date2005-11-17
DetectorADSC QUANTUM 315
Wavelength(s)1.0
Spacegroup nameP 1 21 1
Unit cell lengths52.650, 122.982, 70.268
Unit cell angles90.00, 94.21, 90.00
Refinement procedure
Resolution33.880 - 2.200
R-factor0.1963
Rwork0.194
R-free0.24829
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2e1v
RMSD bond length0.012
RMSD bond angle1.348
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Refinement softwareREFMAC (5.2.0005)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.280
High resolution limit [Å]2.2002.200
Rmerge0.0750.221
Number of reflections40795
<I/σ(I)>18.43.6
Completeness [%]90.259.2
Redundancy3.93
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.529325% PEG 8000, 10% glycerol, 0.1M ammonium sulfate, 0.1M sodium cacodylate, 10% KCl, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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