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1T99

r106g kdo8ps without substrates

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU FR-D
Temperature [K]100
Detector technologyIMAGE PLATE
DetectorRIGAKU RAXIS IV
Wavelength(s)1.5418
Spacegroup nameP 31 2 1
Unit cell lengths84.819, 84.819, 160.262
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution42.410 - 1.850
Rwork0.208
R-free0.24500
Structure solution methodFOURIER SYNTHESIS
Starting model (for MR)1fx6
RMSD bond length0.009
RMSD bond angle1.500
Data reduction softwareCrystalClear ((MSC/RIGAKU))
Data scaling softwared*TREK
Phasing softwareCNS
Refinement softwareCNS (1.1)
Data quality characteristics
 Overall
Low resolution limit [Å]42.410
High resolution limit [Å]1.850
Number of reflections56873
<I/σ(I)>4.7
Completeness [%]98.5
Redundancy10.29
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP4.7277PEG 4K, Na-acetate, pH 4.7, VAPOR DIFFUSION, HANGING DROP, temperature 277K

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