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3UEN

Crystal structure of TopBP1 BRCT4/5 domains

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 8.3.1
Synchrotron siteALS
Beamline8.3.1
Temperature [K]298
Detector technologyCCD
Collection date2007-08-01
DetectorADSC QUANTUM 315r
Wavelength(s)1.11588
Spacegroup nameP 2 2 21
Unit cell lengths35.902, 48.801, 126.088
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution38.590 - 1.900
R-factor0.1775
Rwork0.175
R-free0.22370
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.011
RMSD bond angle1.347
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwarePHASER (2.1.4)
Refinement softwarePHENIX (1.7.2_869)
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]50.00050.0001.930
High resolution limit [Å]1.9005.1601.900
Rmerge0.0770.0260.497
Number of reflections18140
<I/σ(I)>9
Completeness [%]99.898.699.2
Redundancy3.83.63.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.5298PEG 3350, NaSCN, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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