7AVU
Crystal structure of SOS1 in complex with compound 8
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-09-07 |
| Detector | DECTRIS PILATUS 6M-F |
| Wavelength(s) | 0.999920 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 84.480, 39.629, 175.413 |
| Unit cell angles | 90.00, 90.02, 90.00 |
Refinement procedure
| Resolution | 38.930 - 2.100 |
| R-factor | 0.2248 |
| Rwork | 0.224 |
| R-free | 0.26560 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7avi |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.820 |
| Data reduction software | autoPROC |
| Data scaling software | autoPROC (1.1.7) |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.11.7) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 87.706 | 2.342 |
| High resolution limit [Å] | 2.075 | 2.075 |
| Rmerge | 0.087 | 0.546 |
| Number of reflections | 36324 | 727 |
| <I/σ(I)> | 9.8 | 1.6 |
| Completeness [%] | 50.8 | 8.4 |
| Redundancy | 3 | 2.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 277 | 6-11 % PEG 8000, 2 mM DTT, 60 mM Tris |
