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3I9N

Crystal structure of human CD38 complexed with an analog ribo-2'F-ADP ribose

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsCHESS BEAMLINE A1
Synchrotron siteCHESS
BeamlineA1
Temperature [K]100
Detector technologyCCD
Collection date2008-05-17
DetectorADSC QUANTUM 210
Wavelength(s)0.9777
Spacegroup nameP 1
Unit cell lengths41.977, 54.371, 64.258
Unit cell angles109.82, 90.92, 94.86
Refinement procedure
Resolution27.450 - 2.010
R-factor0.21624
Rwork0.213
R-free0.27410
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1yh3
RMSD bond length0.020
RMSD bond angle1.756
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwareMOLREP
Refinement softwareREFMAC (5.4.0067)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]50.0002.070
High resolution limit [Å]2.0002.000
Number of reflections33891
Completeness [%]96.695.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6298100mM MES, pH 6.0, 15% PEG 4000, VAPOR DIFFUSION, HANGING DROP, temperature 298K

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