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2D2H

OpdA from Agrobacterium radiobacter with bound inhibitor trimethyl phosphate at 1.8 A resolution

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU200
Temperature [K]173
Detector technologyIMAGE PLATE
Collection date2004-11-12
DetectorRIGAKU RAXIS IIC
Wavelength(s)1.5418
Spacegroup nameP 31 2 1
Unit cell lengths108.926, 108.926, 62.345
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution19.600 - 1.800
R-factor0.18946
Rwork0.188
R-free0.21430
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.012
RMSD bond angle1.360
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareREFMAC (5.2.0005)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0001.860
High resolution limit [Å]1.8001.800
Number of reflections38568
Completeness [%]97.097.3
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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