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4N5C

Crystal structure of Ypp1

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 24-ID-E
Synchrotron siteAPS
Beamline24-ID-E
Temperature [K]100
Detector technologyCCD
Collection date2012-03-31
DetectorADSC QUANTUM 315
Wavelength(s)0.9792
Spacegroup nameP 1
Unit cell lengths97.545, 136.650, 154.125
Unit cell angles76.69, 85.67, 72.74
Refinement procedure
Resolution25.000 - 3.250
R-factor0.2404
Rwork0.240
R-free0.27720
Structure solution methodMR_SAD
RMSD bond length0.004
RMSD bond angle0.944
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareSHARP
Refinement softwarePHENIX ((phenix.refine: 1.8.2_1309))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]25.0003.370
High resolution limit [Å]3.2503.250
Rmerge0.1120.582
Number of reflections114807
Completeness [%]98.898.7
Redundancy2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.52890.1 Bis-Tris propane [pH 7.5], 0.2 M sodium bromide, 19% PEG 3,350, and 20 mM taurine, VAPOR DIFFUSION, HANGING DROP, temperature 289K

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