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2A2I

Aquifex aeolicus KDO8PS in complex with PEP, A5P, Zn2+

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU FR-D
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2004-12-11
DetectorRIGAKU RAXIS IV
Wavelength(s)1.5418
Spacegroup nameP 31 2 1
Unit cell lengths84.272, 84.272, 159.844
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution25.470 - 1.950
R-factor0.195
Rwork0.195
R-free0.22900
Structure solution methodFOURIER SYNTHESIS
RMSD bond length0.006
RMSD bond angle1.300
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS (1.1)
Data quality characteristics
 Overall
Low resolution limit [Å]25.500
High resolution limit [Å]1.950
Number of reflections46240
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP4.89277PEG4K, Na acetate, pH 4.89, VAPOR DIFFUSION, HANGING DROP, temperature 277K

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