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4K7C

Crystal structure of pepw from lactobacillus rhamnosis hn001 (dr20) determined as the selenomet derivative

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU MICROMAX-002+
Temperature [K]110
Detector technologyIMAGE PLATE
Collection date2006-11-07
DetectorRIGAKU RAXIS IV++
Wavelength(s)1.5418
Spacegroup nameP 63 2 2
Unit cell lengths143.432, 143.432, 97.170
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution33.760 - 1.660
R-factor0.17854
Rwork0.177
R-free0.20968
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3zuk
RMSD bond length0.021
RMSD bond angle2.013
Data reduction softwareCrystalClear
Data scaling softwareCrystalClear
Phasing softwarePHASER
Refinement softwareREFMAC (5.7.0032)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]33.7601.540
High resolution limit [Å]1.4901.490
Rmerge0.0930.412
Number of reflections84251
<I/σ(I)>5.91.2
Completeness [%]87.423.1
Redundancy3.221.12
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP5.42930.1M NaAc, 11% Peg 4K, 30% glycerol protectant, pH 5.4, VAPOR DIFFUSION, SITTING DROP, temperature 293.0K

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