7B42
Crystal structure of c-MET bound by compound 8
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-08-31 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 0.99987 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 112.220, 42.860, 86.960 |
| Unit cell angles | 90.00, 122.23, 90.00 |
Refinement procedure
| Resolution | 55.620 - 1.800 |
| R-factor | 0.203 |
| Rwork | 0.202 |
| R-free | 0.22500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | internal |
| RMSD bond length | 0.010 |
| RMSD bond angle | 0.990 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.11.7) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 55.625 | 1.834 |
| High resolution limit [Å] | 1.800 | 1.803 |
| Rmerge | 0.127 | |
| Rmeas | 0.143 | |
| Rpim | 0.065 | 0.929 |
| Number of reflections | 31290 | 1597 |
| <I/σ(I)> | 9.3 | |
| Completeness [%] | 96.0 | 99.5 |
| Redundancy | 4.9 | 5.2 |
| CC(1/2) | 0.996 | 0.444 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 25 % PEG3350, 0.2 M MgCl2, 0.1 M bis-tris pH 6.5 |
