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6C15

CD1c in complex with phosphatidylcholine

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron siteAustralian Synchrotron
BeamlineMX2
Temperature [K]100
Detector technologyCCD
Collection date2016-02-15
DetectorADSC QUANTUM 315r
Wavelength(s)0.9537
Spacegroup nameP 65 2 2
Unit cell lengths84.255, 84.255, 366.833
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution71.560 - 3.210
R-factor0.21
Rwork0.208
R-free0.24200
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3ov6
RMSD bond length0.010
RMSD bond angle1.220
Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwarePHASER
Refinement softwareBUSTER (2.10.3)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]90.0003.370
High resolution limit [Å]3.2003.200
Rpim0.0470.477
Number of reflections137681952
<I/σ(I)>152
Completeness [%]100.0100
Redundancy43.545.8
CC(1/2)1.0000.904
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP6.529310% Dioxane; 1.6 M Ammonium sulfate; 10 mM MES, pH 6.5

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