3PZH
Crystal structure of maize CK2 alpha in complex with emodin at 1.92 A resolution
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-1 |
| Synchrotron site | ESRF |
| Beamline | ID14-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2007-11-12 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 0.934 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 142.629, 59.376, 44.860 |
| Unit cell angles | 90.00, 103.06, 90.00 |
Refinement procedure
| Resolution | 36.518 - 1.919 |
| R-factor | 0.1611 |
| Rwork | 0.159 |
| R-free | 0.20860 |
| Structure solution method | Rigid Body |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.013 |
| Data scaling software | SCALA (3.3.16) |
| Refinement software | PHENIX (1.6.4_486) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 69.471 | 41.451 | 2.020 |
| High resolution limit [Å] | 1.919 | 6.070 | 1.920 |
| Rmerge | 0.020 | 0.365 | |
| Rmeas | 0.025 | 0.468 | |
| Rpim | 0.015 | 0.289 | |
| Total number of observations | 2213 | 7122 | |
| Number of reflections | 26706 | ||
| <I/σ(I)> | 13.8 | 41.7 | 2.4 |
| Completeness [%] | 95.4 | 92.4 | 86 |
| Redundancy | 2.5 | 2.6 | 2.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8 | 293 | 20% PEG 4000, 0.2M sodium acetate, 0.1M TrisHCl, pH 8, vapor diffusion, sitting drop, temperature 293K |
