7AVS
Crystal structure of SOS1 in complex with compound 6
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 | 83.932, 39.031, 174.752 |
| Unit cell angles | 90.00, 90.06, 90.00 |
Refinement procedure
| Resolution | 38.770 - 2.280 |
| R-factor | 0.2075 |
| Rwork | 0.206 |
| R-free | 0.25940 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7avi |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.870 |
| 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] | 83.932 | 2.485 |
| High resolution limit [Å] | 2.280 | 2.279 |
| Rmerge | 0.112 | 0.818 |
| Number of reflections | 40777 | 816 |
| <I/σ(I)> | 8 | 1.3 |
| Completeness [%] | 77.2 | 17.1 |
| Redundancy | 3.3 | 3.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 277 | 6-11 % PEG 8000, 2 mM DTT, 60 mM Tris |
