5HLN
X-RAY CRYSTAL STRUCTURE OF GSK3B IN COMPLEX WITH CHIR99021
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-E |
Synchrotron site | APS |
Beamline | 24-ID-E |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2010-08-19 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.075 |
Spacegroup name | P 65 |
Unit cell lengths | 163.521, 163.521, 84.930 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 39.280 - 3.100 |
R-factor | 0.1731 |
Rwork | 0.170 |
R-free | 0.23600 |
RMSD bond length | 0.012 |
RMSD bond angle | 1.714 |
Data scaling software | SCALEPACK |
Refinement software | REFMAC (5.8.0103) |
Data quality characteristics
Overall | |
Low resolution limit [Å] | 39.280 |
High resolution limit [Å] | 3.100 |
Number of reflections | 22259 |
<I/σ(I)> | 15.8 |
Completeness [%] | 1.0 |
Redundancy | 4.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6 | 298 | 14% (W/V) PEG 8000, 100 mM MES, pH 6.0 and 100 mM magnesium acetate |