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2DPF

Crystal Structure of curculin1 homodimer

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSPRING-8 BEAMLINE BL24XU
Synchrotron siteSPring-8
BeamlineBL24XU
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2005-12-08
DetectorRIGAKU RAXIS V
Wavelength(s)0.827
Spacegroup nameP 1 21 1
Unit cell lengths51.996, 54.249, 84.055
Unit cell angles90.00, 104.12, 90.00
Refinement procedure
Resolution38.850 - 1.500
R-factor0.221
Rwork0.221
R-free0.25400
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1kj1
RMSD bond length0.006
RMSD bond angle1.500
Data reduction softwareCrystalClear ((MSC/RIGAKU))
Data scaling softwared*TREK
Phasing softwareAMoRE
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]40.0001.450
High resolution limit [Å]1.4001.400
Rmerge0.0500.470
Number of reflections87424
<I/σ(I)>8.31.4
Completeness [%]97.892
Redundancy2.552.21
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP32985% PEG 8000, 0.25M lithium sulfate, 0.1M citrate , pH 3.0, VAPOR DIFFUSION, HANGING DROP, temperature 298.0K

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