3CC6
Crystal structure of kinase domain of protein tyrosine kinase 2 beta (PTK2B)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID29 |
Synchrotron site | ESRF |
Beamline | ID29 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2007-09-13 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 0.9753 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 37.450, 96.140, 43.200 |
Unit cell angles | 90.00, 93.66, 90.00 |
Refinement procedure
Resolution | 18.840 - 1.600 |
R-factor | 0.187 |
Rwork | 0.184 |
R-free | 0.21900 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2etm |
RMSD bond length | 0.010 |
RMSD bond angle | 1.279 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | MOLREP |
Refinement software | REFMAC |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 18.840 | 1.700 |
High resolution limit [Å] | 1.600 | 1.600 |
Rmerge | 0.081 | 0.441 |
Number of reflections | 40123 | 6650 |
<I/σ(I)> | 16.22 | 4.6 |
Completeness [%] | 99.9 | 100 |
Redundancy | 7.4 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 277 | 0.05M Magnesium chloride, 0.1M Bis-tris, 17.5% PEG 3350, pH 5.5, VAPOR DIFFUSION, SITTING DROP, temperature 277K |