1F3M
CRYSTAL STRUCTURE OF HUMAN SERINE/THREONINE KINASE PAK1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 14-BM-C |
| Synchrotron site | APS |
| Beamline | 14-BM-C |
| Temperature [K] | 113 |
| Detector technology | CCD |
| Collection date | 1999-08-15 |
| Detector | ADSC QUANTUM 4 |
| Spacegroup name | P 41 |
| Unit cell lengths | 94.583, 94.583, 147.497 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 34.080 - 2.300 |
| R-factor | 0.237 * |
| Rwork | 0.237 |
| R-free | 0.25800 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.320 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | CNS |
| Refinement software | CNS |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 34.080 | 2.370 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Rmerge | 0.069 | 0.349 |
| Total number of observations | 160255 * | |
| Number of reflections | 56156 | |
| <I/σ(I)> | 15.4 | |
| Completeness [%] | 97.9 | 97.4 |
| Redundancy | 3 | 3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 * | 12 * | Ammonium Sulfate, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 285K |
Crystallization Reagents in Literatures
| ID | crystal ID | solution | reagent name | concentration (unit) | details |
| 1 | 1 | reservoir | ammonium sulfate | 1.8-1.9 (M) | |
| 2 | 1 | reservoir | 150 (mM) | ||
| 3 | 1 | reservoir | 250-300 (mM) | ||
| 4 | 1 | reservoir | dithiothreitol | 10 (mM) | |
| 5 | 1 | reservoir | PIPES | 100 (mM) | |
| 6 | 1 | drop | 125 (mM) | ||
| 7 | 1 | drop | Tris-HCl | 20 (mM) | |
| 8 | 1 | drop | protein | 15-20mg |
