6TWZ
14-3-3 sigma complexed with a phosphorylated 16E6 peptide
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-12-09 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 1 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 178.580, 107.420, 79.600 |
| Unit cell angles | 90.00, 109.29, 90.00 |
Refinement procedure
| Resolution | 48.560 - 2.800 |
| R-factor | 0.2043 |
| Rwork | 0.203 |
| R-free | 0.23560 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5lu2 |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.555 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.14_3260) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 49.000 | 2.870 |
| High resolution limit [Å] | 2.800 | 2.800 |
| Number of reflections | 34835 | 2543 |
| <I/σ(I)> | 13.23 | 1.2 |
| Completeness [%] | 99.2 | |
| Redundancy | 6.9 | |
| CC(1/2) | 0.999 | 0.458 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 277 | 20% PEG3350, 0.1M Bis-Tris-Propane (pH 6.5), 0.2M K/Na-tartarate |
