4UT3
X-ray structure of the human PP1 gamma catalytic subunit treated with hydrogen peroxide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-12-19 |
| Detector | DECTRIS PILATUS 6M |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 38.450, 105.220, 89.820 |
| Unit cell angles | 90.00, 90.34, 90.00 |
Refinement procedure
| Resolution | 45.400 - 2.190 |
| R-factor | 0.17518 |
| Rwork | 0.173 |
| R-free | 0.21146 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2o8a |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.267 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.400 | 2.260 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Rmerge | 0.080 | 0.620 |
| Number of reflections | 35328 | |
| <I/σ(I)> | 7.9 | 2.1 |
| Completeness [%] | 97.5 | 97.3 |
| Redundancy | 3.3 | 3.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 9 | 7-12% PEG3350, 0.1 M BICINE, PH 9.0 SOAKING IN RESERVOIR ENRICHED WITH 50MM H2O2 FOR 10 MINS CRYOPROTECTION IN RESEVOIR ENRICHED WITH 25% MPD |
