6QQN
Tubulin-TH588 complex
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 | 2018-12-05 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 1.00002 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 103.832, 156.186, 179.432 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 47.484 - 2.301 |
| R-factor | 0.1983 |
| Rwork | 0.196 |
| R-free | 0.24420 |
| Structure solution method | FOURIER SYNTHESIS |
| Starting model (for MR) | 5lxt |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.519 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((1.13_2998: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.500 | 2.360 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Rmerge | 0.197 | 4.103 |
| Rmeas | 0.205 | 4.261 |
| Rpim | 0.057 | 1.218 |
| Number of reflections | 249775 | 9434 |
| <I/σ(I)> | 11.3 | |
| Completeness [%] | 99.9 | 99.6 |
| Redundancy | 13.6 | 13.7 |
| CC(1/2) | 0.998 | 0.220 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 6.7 | 293 | 1% PEG 4K, 8% glycerol, 30 mM MgCl2, 30 mM CaCl2, 0.1 M MES/Imidazole pH 6.7 |
