7BM9
Crystal structure of 14-3-3 sigma in complex with CIP2ApS904 peptide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SEALED TUBE |
| Source details | RIGAKU MICROMAX-003 |
| Temperature [K] | 298 |
| Detector technology | PIXEL |
| Collection date | 2020-09-01 |
| Detector | DECTRIS PILATUS 200K |
| Wavelength(s) | 1.5419 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 82.554, 112.317, 62.809 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 41.860 - 1.800 |
| R-factor | 0.1415 |
| Rwork | 0.139 |
| R-free | 0.18650 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4jc3 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.870 |
| Data reduction software | DIALS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (1.13_2998) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 41.880 | 1.830 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.092 | 0.305 |
| Number of reflections | 26877 | 1251 |
| <I/σ(I)> | 15.5 | 4.8 |
| Completeness [%] | 98.2 | 92.7 |
| Redundancy | 6.3 | |
| CC(1/2) | 0.997 | 0.929 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 277 | 0.095 M Hepes pH 7.1, 25% PEG 400, 0.19 M CaCl2 and 5% Glycerol |
