5EZ0
CRYSTAL STRUCTURE OF THE PTPN4 PDZ DOMAIN COMPLEXED WITH THE PDZ BINDING MOTIF OF THE MITOGEN ACTIVATED PROTEIN KINASE P38GAMMA.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 1 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 1 |
| Temperature [K] | 291 |
| Detector technology | PIXEL |
| Collection date | 2011-11-25 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.95373 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 68.564, 76.121, 198.676 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.330 - 2.350 |
| R-factor | 0.2295 |
| Rwork | 0.228 |
| R-free | 0.25170 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3nfk |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.960 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | BUSTER-TNT (BUSTER 2.11.4) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.350 | 2.480 |
| High resolution limit [Å] | 2.350 | 2.350 |
| Rmerge | 0.076 | 0.500 |
| Number of reflections | 21504 | |
| <I/σ(I)> | 12.7 | 2.2 |
| Completeness [%] | 97.5 | 93.7 |
| Redundancy | 4.6 | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 10.5 | 291 | 1.2 M SODIUM DI-HYDROGEN PHOSPHATE 0.8 M DI-POTASSIUM HYDROGEN PHOSPHATE 0.1M CAPS 0.2 M Lithium sulfate 0.67 M Non-Detergent Sulfobetaine (NDSB) 201 |
