6TDE
Tubulin-inhibitor complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 1 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-05-27 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.978570 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 64.477, 128.142, 251.117 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 45.000 - 2.286 |
| R-factor | 0.1993 |
| Rwork | 0.198 |
| R-free | 0.23160 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3ryc |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.970 |
| Data reduction software | XDS (Mar 15, 2019) |
| Data scaling software | autoPROC (1.05) |
| Phasing software | PHASER (2.8.0) |
| Refinement software | BUSTER (2.10.3 (23-SEP-2019)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 125.000 | 2.550 |
| High resolution limit [Å] | 2.286 | 2.286 |
| Rmeas | 0.071 | 1.055 |
| Number of reflections | 49337 | 2468 |
| <I/σ(I)> | 14 | |
| Completeness [%] | 93.9 | 78.6 |
| Redundancy | 6.5 | 6.4 |
| CC(1/2) | 0.999 | 0.725 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | PEG, LiSO4, PIPES BUFFER, pH 6.80 |
