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4K80

Crystal structure of human ceramide-1-phosphate transfer protein (CPTP) in complex with 2:0 ceramide-1-phosphate (2:0-C1P)

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSLS BEAMLINE X29A
Synchrotron siteNSLS
BeamlineX29A
Temperature [K]100
Detector technologyCCD
Collection date2009-08-03
DetectorADSC QUANTUM 315
Wavelength(s)1.08090
Spacegroup nameP 41 21 2
Unit cell lengths74.433, 74.433, 105.402
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution28.144 - 2.051
R-factor0.1699
Rwork0.168
R-free0.21840
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)CPTP in complex with C8 ceramide -1-phosphate
RMSD bond length0.007
RMSD bond angle0.906
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwarePHENIX (1.6_289)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.120
High resolution limit [Å]2.0502.050
Rmerge0.0720.495
Number of reflections20690
<I/σ(I)>32.1694.079
Completeness [%]99.9100
Redundancy9.39.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP7.52930.2 M Ammonium acetate, 0.1 M HEPES pH 7.5, 25% PEG3350, VAPOR DIFFUSION, SITTING DROP, temperature 293K

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