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4OC7

Retinoic acid receptor alpha in complex with (E)-3-(3'-allyl-6-hydroxy-[1,1'-biphenyl]-3-yl)acrylic acid and a fragment of the coactivator TIF2

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X06DA
Synchrotron siteSLS
BeamlineX06DA
Temperature [K]100
Detector technologyPIXEL
Collection date2013-10-19
DetectorPSI PILATUS 6M
Wavelength(s)0.97794
Spacegroup nameP 43 21 2
Unit cell lengths67.554, 67.554, 110.075
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution47.768 - 2.500
R-factor0.1999
Rwork0.198
R-free0.24240
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.004
RMSD bond angle0.750
Data reduction softwareXDS
Data scaling softwareSCALA
Phasing softwarePHASER
Refinement softwarePHENIX (1.8.4_1496)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]47.7702.640
High resolution limit [Å]2.5002.500
Number of reflections9327
<I/σ(I)>2.2
Completeness [%]98.8100
Redundancy25.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.52770.1 M Na HEPES pH 7.5, 20% PEG 2000 MME, VAPOR DIFFUSION, HANGING DROP, temperature 277K

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