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3W52

Zinc-dependent bifunctional nuclease

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSRRC BEAMLINE BL13B1
Synchrotron siteNSRRC
BeamlineBL13B1
Temperature [K]100
Detector technologyCCD
Collection date2012-03-21
DetectorADSC QUANTUM 315
Wavelength(s)0.9732
Spacegroup nameP 21 21 21
Unit cell lengths54.254, 66.727, 99.487
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution25.000 - 1.760
R-factor0.171
Rwork0.167
R-free0.19600
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1ak0
RMSD bond length0.020
RMSD bond angle2.000
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]25.0001.820
High resolution limit [Å]1.7601.760
Rmerge0.0840.337
Number of reflections36392
<I/σ(I)>27.44.6
Completeness [%]99.494
Redundancy7.75.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP8.529850mM NaCl, 20mM Tris(pH7.5), 125 micro-M thiophosphorylated adenosine hexanucleotide, 30%(w/v) PEG3350, 0.2M Li2SO4, 0.1M Tris, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 298K

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