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1UZ2

The Cys121Ser Mutant of Beta-Lactoglobulin

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSRS BEAMLINE PX14.1
Synchrotron siteSRS
BeamlinePX14.1
Temperature [K]100
Detector technologyCCD
Collection date2003-02-15
DetectorADSC CCD
Spacegroup nameC 2 2 21
Unit cell lengths55.690, 80.470, 66.590
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution45.640 - 1.950
R-factor0.213
Rwork0.267
R-free0.26700
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1qg5
RMSD bond length0.025
RMSD bond angle2.061
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwareCNS
Refinement softwareREFMAC (5.0)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]46.0002.000
High resolution limit [Å]1.9501.950
Rmerge0.0760.230
Number of reflections11241
<I/σ(I)>5.72.6
Completeness [%]99.599.5
Redundancy5.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.5HANGING DROPS WITH 20 MG/ML PROTEIN PLUS APPROX 2M AMMONIUM SULPHATE, 10MM HEPES, PH 7.5

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