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2ACI

Structure of D166A arginine deiminase

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2004-03-22
DetectorRIGAKU RAXIS IV
Wavelength(s)1.54178
Spacegroup nameP 21 21 21
Unit cell lengths91.200, 123.900, 150.000
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution20.000 - 2.500
Rwork0.198
R-free0.27200
Structure solution methodFOURIER SYNTHESIS
Starting model (for MR)2a9g
RMSD bond length0.015
RMSD bond angle1.900
Data reduction softwareCrystalClear ((MSC/RIGAKU))
Data scaling softwareCrystalClear ((MSC/RIGAKU))
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0002.590
High resolution limit [Å]2.5002.500
Rmerge0.0970.361
Number of reflections55706
Completeness [%]93.892.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.629836% MPD (2-methyl-2,4-pentanediol), 6% PEG 3350, 0.1 M Tris-HCl (pH 7.6), L-arginine 0.02 M , VAPOR DIFFUSION, HANGING DROP, temperature 298.0K

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