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5CFP

Crystal structure of anemone STING (Nematostella vectensis) 'humanized' F276K in complex with 3', 3' c-di-GMP, c[G(3', 5')pG(3', 5')p]'

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 8.3.1
Synchrotron siteALS
Beamline8.3.1
Temperature [K]80
Detector technologyCCD
Collection date2015-03-06
DetectorADSC QUANTUM 315r
Wavelength(s)1.11588
Spacegroup nameP 31
Unit cell lengths81.388, 81.388, 100.553
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution40.931 - 2.066
R-factor0.174
Rwork0.172
R-free0.20550
Structure solution methodSAD
RMSD bond length0.009
RMSD bond angle1.298
Data reduction softwareXDS
Data scaling softwareAimless
Phasing softwarePHASER
Refinement softwarePHENIX (1.9_1692)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]40.9312.120
High resolution limit [Å]2.0662.066
Rmerge0.0520.901
Number of reflections45536
<I/σ(I)>81.1
Completeness [%]99.694.6
Redundancy6.46
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP2911.8 M ammonium citrate pH 7.0

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