6BCY
Complex of 14-3-3 theta with an IRSp53 peptide phosphorylated at T360
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CHESS BEAMLINE A1 |
| Synchrotron site | CHESS |
| Beamline | A1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-10-23 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 0.9769 |
| Spacegroup name | P 1 |
| Unit cell lengths | 59.370, 68.630, 84.790 |
| Unit cell angles | 72.91, 85.59, 64.65 |
Refinement procedure
| Resolution | 21.847 - 2.300 |
| R-factor | 0.1934 |
| Rwork | 0.192 |
| R-free | 0.22180 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2br9 |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.457 |
| Data scaling software | XSCALE |
| Phasing software | PHASER (2.3.0) |
| Refinement software | PHENIX (1.12_2829) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 21.847 | 2.380 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Rmerge | 0.087 | 0.579 |
| Number of reflections | 49462 | 4819 |
| <I/σ(I)> | 12.5 | 3.6 |
| Completeness [%] | 96.6 | 94.3 |
| Redundancy | 3.6 | 3.2 |
| CC(1/2) | 0.996 | 0.870 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 291.15 | 0.1M Magnesium Formate, 13% Peg 3350, 4% 2,2,2-Trifluoroethanol |
