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2QLP

Bifunctional dCTP deaminase:dUTPase from Mycobacterium tuberculosis, apo form

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID14-3
Synchrotron siteESRF
BeamlineID14-3
Temperature [K]100
Detector technologyCCD
Collection date2007-02-22
DetectorADSC QUANTUM 4
Wavelength(s)0.931
Spacegroup nameP 1 21 1
Unit cell lengths62.800, 96.700, 78.000
Unit cell angles90.00, 97.70, 90.00
Refinement procedure
Resolution19.900 - 2.470
R-factor0.232
Rwork0.228
R-free0.29500
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.011
RMSD bond angle1.497
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwareMOLREP
Refinement softwareREFMAC
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.000
High resolution limit [Å]2.4702.470
Rmerge0.1930.551
Number of reflections32512
<I/σ(I)>6.812.2
Completeness [%]99.199
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.52771.9mg/ml enzyme in 50mM HEPES pH 6.8 Reservoir: 20% PEG 8K, 50mM MgCl2, 100mM HEPES pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 277K

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