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2D2G

OpdA from Agrobacterium radiobacter with bound product dimethylthiophosphate

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU200
Temperature [K]173
Detector technologyIMAGE PLATE
Collection date2004-11-10
DetectorRIGAKU RAXIS IIC
Wavelength(s)1.5148
Spacegroup nameP 31 2 1
Unit cell lengths108.956, 108.956, 62.672
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution25.000 - 1.850
R-factor0.16742
Rwork0.166
R-free0.19367
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.013
RMSD bond angle1.300
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareREFMAC (5.2.0005)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]25.0001.920
High resolution limit [Å]1.8501.850
Number of reflections35872
Completeness [%]97.797.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.627720% PEG 3350, 0.2M NaNO3, pH 6.6, VAPOR DIFFUSION, HANGING DROP, temperature 277K

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