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9MHY

Human TLR8 ectodomain with small molecule agonist 1

This is a non-PDB format compatible entry.
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 17-ID
Synchrotron siteAPS
Beamline17-ID
Temperature [K]100
Detector technologyPIXEL
Collection date2020-11-11
DetectorDECTRIS EIGER2 X 9M
Wavelength(s)1
Spacegroup nameP 1
Unit cell lengths72.580, 82.410, 83.440
Unit cell angles116.05, 97.71, 98.68
Refinement procedure
Resolution73.030 - 1.660
R-factor0.202
Rwork0.201
R-free0.22300
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.008
RMSD bond angle1.000
Data reduction softwareXDS
Data scaling softwareXDS
Phasing softwarePHASER
Refinement softwareBUSTER (2.11.7 (20-MAY-2020))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]73.0301.830
High resolution limit [Å]1.6601.660
Number of reflections20291210634
<I/σ(I)>13.91.7
Completeness [%]81.1
Redundancy1.8
CC(1/2)0.9990.615
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP2950.2 M magnesium formate, 20% (w/v) PEG 3,350, 0.1 M TCEP

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