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4H9W

crystal structure of a METHIONINE mutant of WCI

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsBRUKER AXS MICROSTAR
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2011-08-02
DetectorMAR scanner 345 mm plate
Wavelength(s)1.5418
Spacegroup nameP 61 2 2
Unit cell lengths61.632, 61.632, 211.791
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution30.000 - 2.500
Rwork0.221
R-free0.25650
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1eyl
Data reduction softwareAUTOMAR
Phasing softwareMOLREP
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.000
High resolution limit [Å]2.5002.500
Rmerge0.0550.055
Number of reflections8893
<I/σ(I)>7.17.1
Completeness [%]99.299.2
Redundancy7.057.05
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP42770.3M AMS, 5% GLYCEROL, 25% PEG 6K, pH 4, VAPOR DIFFUSION, HANGING DROP, temperature 277K

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