1NXK
Crystal structure of staurosporine bound to MAP KAP kinase 2
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 5.0.2 |
Synchrotron site | ALS |
Beamline | 5.0.2 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2002-06-15 |
Detector | ADSC QUANTUM 4 |
Wavelength(s) | 1.1 |
Spacegroup name | P 63 |
Unit cell lengths | 160.202, 160.202, 133.481 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 20.000 - 2.700 |
R-factor | 0.23872 |
Rwork | 0.239 |
R-free | 0.27400 * |
Structure solution method | MAD |
RMSD bond length | 0.018 |
RMSD bond angle | 2.360 |
Data scaling software | SCALEPACK |
Phasing software | SHARP |
Refinement software | REFMAC (5.1.19) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.800 |
High resolution limit [Å] | 2.700 | 2.700 |
Rmerge | 0.047 | 0.481 |
Total number of observations | 215726 * | |
Number of reflections | 52352 | |
<I/σ(I)> | 20.2 | 1.6 |
Completeness [%] | 100.0 * | 100 * |
Redundancy | 4.1 | 3.01 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | Vapor diffusion * | 7.5 | 296 | 2M ammonium sulfate, 100 mM HEPES pH 7.5, 2% PEG 400, VAPOR DIFFUSION, HANGING DROP, temperature 296K |
1 | Vapor diffusion * | 7.5 | 296 | 2M ammonium sulfate, 100 mM HEPES pH 7.5, 2% PEG 400, VAPOR DIFFUSION, HANGING DROP, temperature 296K |
1 | Vapor diffusion * | 7.5 | 296 | 2M ammonium sulfate, 100 mM HEPES pH 7.5, 2% PEG 400, VAPOR DIFFUSION, HANGING DROP, temperature 296K |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 5 (mg/ml) | |
2 | 1 | reservoir | HEPES | 20 (mM) | pH7.5 |
3 | 1 | reservoir | 200 (mM) | ||
4 | 1 | reservoir | dithiothreitol | 10 (mM) | |
5 | 1 | reservoir | 5 (mM) |