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3VJH

Human PPAR GAMMA ligand binding domain in complex with JKPL35

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPHOTON FACTORY BEAMLINE BL-5A
Synchrotron sitePhoton Factory
BeamlineBL-5A
Temperature [K]100
Detector technologyCCD
Collection date2008-11-15
DetectorADSC QUANTUM 315
Wavelength(s)1.0000
Spacegroup nameC 1 2 1
Unit cell lengths92.973, 60.489, 117.956
Unit cell angles90.00, 103.35, 90.00
Refinement procedure
Resolution20.000 - 2.220
R-factor0.20827
Rwork0.206
R-free0.24689
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2prg
RMSD bond length0.010
RMSD bond angle1.069
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareREFMAC (5.6.0113)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.300
High resolution limit [Å]2.2202.220
Rmerge0.0350.126
Number of reflections30877
<I/σ(I)>16.77.5
Completeness [%]98.191.2
Redundancy3.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.52930.8M Sodium citrate, 0.1M HEPES (pH7.5), VAPOR DIFFUSION, HANGING DROP, temperature 293K

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