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2RK4

Structure of M26I DJ-1

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRL BEAMLINE BL11-1
Synchrotron siteSSRL
BeamlineBL11-1
Temperature [K]110
Detector technologyCCD
Collection date2005-04-25
DetectorADSC QUANTUM 315
Wavelength(s)0.827
Spacegroup nameP 31 2 1
Unit cell lengths74.770, 74.770, 75.060
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution50.000 - 1.150
R-factor0.1294
Rwork0.129
R-free0.15620
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1p5f
RMSD bond length0.014
RMSD bond angle0.030
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Refinement softwareSHELXL-97
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0001.190
High resolution limit [Å]1.1501.150
Rmerge0.0680.560
Number of reflections86085
<I/σ(I)>23.42.3
Completeness [%]99.999.5
Redundancy6.54.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.529830% PEG 3000, 100 mM HEPES, 200 mM NaCl, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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