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2P5R

Crystal structure of the poplar glutathione peroxidase 5 in the oxidized form

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE BM30A
Synchrotron siteESRF
BeamlineBM30A
Temperature [K]100
Detector technologyCCD
Collection date2004-12-15
DetectorADSC QUANTUM 315
Wavelength(s)0.80630
Spacegroup nameP 31 2 1
Unit cell lengths71.580, 71.580, 117.820
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution50.000 - 2.450
R-factor0.218
Rwork0.211
R-free0.28000
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.006
RMSD bond angle1.300
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.490
High resolution limit [Å]2.4502.450
Rmerge0.0620.335
Number of reflections13374
<I/σ(I)>6.2
Completeness [%]99.8100
Redundancy7.67.79
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1MICROBATCH8.529325 % PEG 4000, 0.1 M Tris-HCl, 0.2 M calcium chloride, pH 8.5, Microbatch, temperature 293K

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