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2ZHX

Crystal structure of Uracil-DNA Glycosylase from Mycobacterium tuberculosis in complex with a proteinaceous inhibitor

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU200
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2006-03-20
DetectorMAR scanner 345 mm plate
Wavelength(s)1.5418
Spacegroup nameC 1 2 1
Unit cell lengths201.143, 64.274, 203.677
Unit cell angles90.00, 109.72, 90.00
Refinement procedure
Resolution30.000 - 3.100
R-factor0.23581
Rwork0.234
R-free0.27638
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1ugh 1UUG and 1UDI
RMSD bond length0.013
RMSD bond angle1.435
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwarePHASES
Refinement softwareREFMAC (5.2.0019)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0003.210
High resolution limit [Å]3.1003.100
Number of reflections43788
<I/σ(I)>8.22.4
Completeness [%]97.291.8
Redundancy2.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.229810%(w/v) PEG 8000 and 0.2M NaCl in 0.1M phosphate buffer pH 6.2, VAPOR DIFFUSION, HANGING DROP, temperature 298.0K

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