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3UEU

Bovine beta-lactoglobulin complex with lauric acid

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSEALED TUBE
Source detailsOTHER
Temperature [K]110
Detector technologyCCD
Collection date2009-10-20
DetectorAGILENT ATLAS CCD
Wavelength(s)1.54
Spacegroup nameP 32 2 1
Unit cell lengths52.870, 52.870, 110.503
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution11.380 - 2.100
R-factor0.21412
Rwork0.209
R-free0.25504
Structure solution methodMOLREP
Starting model (for MR)1bsy
RMSD bond length0.015
RMSD bond angle1.764
Data reduction softwareCrysalisPro
Data scaling softwareSCALA
Phasing softwareMOLREP
Refinement softwareREFMAC (5.2.0005)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]11.3802.210
High resolution limit [Å]2.1002.100
Rmerge0.0440.169
Number of reflections10865
<I/σ(I)>11.52.8
Completeness [%]99.299.2
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.52931.34 M trisodium citrarte, 0.1 Tris-HCl buffer, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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