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2EU8

Crystal structure of a thermostable mutant of Bacillus subtilis Adenylate Kinase (Q199R)

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2005-01-10
DetectorRIGAKU RAXIS IV
Wavelength(s)1.5418
Spacegroup nameP 1 21 1
Unit cell lengths34.690, 75.140, 77.350
Unit cell angles90.00, 98.13, 90.00
Refinement procedure
Resolution37.570 - 1.800
R-factor0.2289
Rwork0.187
R-free0.22400
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1zin
RMSD bond length0.005
RMSD bond angle1.235
Data reduction softwareCrystalClear ((MSC/RIGAKU))
Data scaling softwared*TREK (8.0SSI)
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]37.5701.660
High resolution limit [Å]1.6001.600
Rmerge0.0360.096
Number of reflections48747
<I/σ(I)>21.78.7
Completeness [%]94.080.4
Redundancy3.843.47
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP9293.140.75mM protein, PEG1500, Calcium Chloride, Ches, pH 9.0, VAPOR DIFFUSION, HANGING DROP, temperature 293.14K

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