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9IJN

STING LBD domain with an agonist DW18343

This is a non-PDB format compatible entry.
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRF BEAMLINE BL17U1
Synchrotron siteSSRF
BeamlineBL17U1
Temperature [K]100
Detector technologyCCD
Collection date2021-08-29
DetectorADSC QUANTUM 315r
Wavelength(s)0.979
Spacegroup nameP 41 21 2
Unit cell lengths110.040, 110.040, 35.760
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution34.800 - 1.810
R-factor0.1984
Rwork0.197
R-free0.23300
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.013
RMSD bond angle1.391
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHENIX
Refinement softwarePHENIX ((1.17.1_3660: ???))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]34.8001.860
High resolution limit [Å]1.8101.810
Rmerge0.0830.468
Number of reflections205982713
<I/σ(I)>11.5
Completeness [%]99.9
Redundancy4.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP289.1520% w/v Polyethylene glycol monomethyl ether 5,000 and 0.1 M Bis-Tris pH 6.5

246031

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