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4NRE

The structure of human 15-lipoxygenase-2 with a substrate mimic

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 24-ID-E
Synchrotron siteAPS
Beamline24-ID-E
Temperature [K]100
Detector technologyCCD
Collection date2011-12-05
DetectorADSC QUANTUM 4
Wavelength(s)0.97923
Spacegroup nameH 3 2
Unit cell lengths155.794, 155.794, 263.219
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution38.949 - 2.630
R-factor0.165
Rwork0.163
R-free0.20330
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.006
RMSD bond angle0.721
Data reduction softwareXDS
Data scaling softwareXDS
Phasing softwarePHASER
Refinement softwarePHENIX ((phenix.refine: 1.8.4_1496))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]47.5502.770
High resolution limit [Å]2.6302.630
Number of reflections34599
Completeness [%]99.769.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP5.5295.151M (NH4)2SO4, 0.1M BisTris pH 5.5, 5% Glycerol, 24mM C8E4, 40mM CaCl2 soak for 30 min, VAPOR DIFFUSION, HANGING DROP, temperature 295.15K

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