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3CC6

Crystal structure of kinase domain of protein tyrosine kinase 2 beta (PTK2B)

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID29
Synchrotron siteESRF
BeamlineID29
Temperature [K]100
Detector technologyCCD
Collection date2007-09-13
DetectorADSC QUANTUM 315
Wavelength(s)0.9753
Spacegroup nameP 1 21 1
Unit cell lengths37.450, 96.140, 43.200
Unit cell angles90.00, 93.66, 90.00
Refinement procedure
Resolution18.840 - 1.600
R-factor0.187
Rwork0.184
R-free0.21900
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2etm
RMSD bond length0.010
RMSD bond angle1.279
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwareMOLREP
Refinement softwareREFMAC
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]18.8401.700
High resolution limit [Å]1.6001.600
Rmerge0.0810.441
Number of reflections401236650
<I/σ(I)>16.224.6
Completeness [%]99.9100
Redundancy7.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP5.52770.05M Magnesium chloride, 0.1M Bis-tris, 17.5% PEG 3350, pH 5.5, VAPOR DIFFUSION, SITTING DROP, temperature 277K

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