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3E3D

Structure of hen egg white lysozyme with the magic triangle I3C

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsMACSCIENCE
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2007-09-20
DetectorMAR scanner 345 mm plate
Wavelength(s)1.54178
Spacegroup nameP 43 21 2
Unit cell lengths76.830, 76.830, 38.870
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution19.400 - 1.550
R-factor0.173
Rwork0.171
R-free0.22000
Structure solution methodSAD
RMSD bond length0.007
RMSD bond angle0.023
Data reduction softwareXDS
Data scaling softwareSADABS
Phasing softwareSHELXD
Refinement softwareSHELX
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]19.4001.650
High resolution limit [Å]1.5501.550
Rmerge0.0690.150
Number of reflections17445
<I/σ(I)>38.221.2
Completeness [%]99.899.5
Redundancy26.124
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP72930.1M HEPES, 15%(wt/wt) PEG 3350, 8mM sodium I3C(magic triangle) solution, pH 7.0, VAPOR DIFFUSION, SITTING DROP, temperature 293K

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