6YLU
14-3-3sigma in complex with BLNKpT152 phosphopeptide crystal structure
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SEALED TUBE |
| Source details | RIGAKU MICROMAX-003 |
| Temperature [K] | 80 |
| Detector technology | PIXEL |
| Collection date | 2016-11-14 |
| Detector | DECTRIS PILATUS3 R 200K-A |
| Wavelength(s) | 1.541 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 82.250, 112.110, 62.520 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 26.630 - 1.880 |
| R-factor | 0.1603 |
| Rwork | 0.158 |
| R-free | 0.21110 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3mhr |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.805 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.17.1-3660) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 26.630 | 1.930 |
| High resolution limit [Å] | 1.880 | 1.880 |
| Rmerge | 0.123 | |
| Rmeas | 0.152 | |
| Rpim | 0.089 | |
| Number of reflections | 23758 | 1473 |
| <I/σ(I)> | 8.8 | |
| Completeness [%] | 99.9 | |
| Redundancy | 5.1 | |
| CC(1/2) | 0.990 | 0.915 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 277.15 | 95 mM Hepes pH 7.1-7.7, 24-29% PEG400, 190 mM CaCl2, Glycerol 5% |
