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3GMN

Structure of mouse CD1d in complex with C10Ph

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRL BEAMLINE BL11-1
Synchrotron siteSSRL
BeamlineBL11-1
Temperature [K]100
Detector technologyCCD
Collection date2007-11-16
DetectorMARMOSAIC 325 mm CCD
Wavelength(s)0.9795
Spacegroup nameP 1 21 1
Unit cell lengths41.670, 97.870, 55.410
Unit cell angles90.00, 106.44, 90.00
Refinement procedure
Resolution27.800 - 1.700
R-factor0.17864
Rwork0.177
R-free0.21767
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3gml
RMSD bond length0.023
RMSD bond angle2.114
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwarePHASER
Refinement softwareREFMAC (5.5.0066)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]30.0001.800
High resolution limit [Å]1.7001.700
Number of reflections46034
<I/σ(I)>212.6
Completeness [%]98.297.7
Redundancy3.83.8
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP4.52950.2 M Malonate pH 4.5, 20%(v/v) PEG3350, VAPOR DIFFUSION, SITTING DROP, temperature 295K

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