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3MA7

Crystal structure of Cardiolipin bound to mouse CD1D

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSSRL BEAMLINE BL7-1
Synchrotron siteSSRL
BeamlineBL7-1
Temperature [K]100
Detector technologyCCD
Collection date2007-04-21
DetectorADSC QUANTUM 315r
Spacegroup nameP 1
Unit cell lengths46.773, 50.921, 103.165
Unit cell angles102.15, 92.22, 106.21
Refinement procedure
Resolution44.680 - 2.290
R-factor0.234
Rwork0.232
R-free0.27300
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2akr
RMSD bond length0.013
RMSD bond angle1.484
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareMOLREP
Refinement softwareREFMAC (5.5.0054)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.380
High resolution limit [Å]2.2902.290
Rmerge0.0910.384
Number of reflections37815
<I/σ(I)>12.91.9
Completeness [%]95.488.4
Redundancy1.91.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
120% POLYETHYLENE GLYCOL 4000, 300MM CALCIUM ACETATE, 6% ETHYLENE GLYCOL, VAPOR DIFFUSION, SITTING DROP, TEMPERATURE 295K

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