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2QHS

Structural Basis of Octanoic Acid Recognition by Lipoate-Protein Ligase B

Experimental procedure
Experimental methodMAD
Source typeSYNCHROTRON
Source detailsPHOTON FACTORY BEAMLINE BL-5A
Synchrotron sitePhoton Factory
BeamlineBL-5A
Temperature [K]110
Detector technologyCCD
DetectorADSC QUANTUM 4
Wavelength(s)0.97925, 0.97942, 0.95000
Spacegroup nameP 41 21 2
Unit cell lengths63.717, 63.717, 114.024
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution20.000 - 1.500
R-factor0.18701
Rwork0.185
R-free0.20823
Structure solution methodMAD
RMSD bond length0.008
RMSD bond angle1.209
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareSOLVE
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 Overall
Low resolution limit [Å]20.000
High resolution limit [Å]1.500
Number of reflections38216
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP729850mM HEPES at pH 7.0, 4.0M lithium chloride, 5%(v/v) PEG 8000, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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