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7WDJ

The 0.90 angstrom X-ray structure of the human heart fatty acid-binding protein complexed with linoleic acid

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL44XU
Synchrotron siteSPring-8
BeamlineBL44XU
Temperature [K]100
Detector technologyCCD
Collection date2012-10-12
DetectorRAYONIX MX225HE
Wavelength(s)0.75000
Spacegroup nameP 21 21 21
Unit cell lengths54.620, 69.733, 33.617
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution30.300 - 0.900
R-factor0.11902
Rwork0.119
R-free0.12647
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3wvm
RMSD bond length0.021
RMSD bond angle2.298
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareMOLREP
Refinement softwareREFMAC (5.8.0238)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]43.0000.920
High resolution limit [Å]0.9000.900
Rmerge0.0650.387
Number of reflections952064699
<I/σ(I)>9.13.2
Completeness [%]99.5
Redundancy11.9
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP2930.1M Hepes-NaOH (pH7.5), 60% PEG 400 or 0.1M Glycine-NaOH (pH9.0), 60% PEG 400

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