6O0U
Crystal structure of the TIR domain H685A mutant from human SARM1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-11-11 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.954 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 32.997, 71.309, 57.242 |
| Unit cell angles | 90.00, 97.52, 90.00 |
Refinement procedure
| Resolution | 44.400 - 3.030 |
| R-factor | 0.1897 |
| Rwork | 0.184 |
| R-free | 0.23430 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.537 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.14_3260: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.400 | 3.210 |
| High resolution limit [Å] | 3.030 | 3.030 |
| Rmerge | 0.277 | 0.732 |
| Rmeas | 0.306 | 0.809 |
| Rpim | 0.128 | 0.340 |
| Number of reflections | 5181 | 818 |
| <I/σ(I)> | 4.8 | 1.8 |
| Completeness [%] | 99.8 | 100 |
| Redundancy | 5.6 | 5.6 |
| CC(1/2) | 0.971 | 0.734 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.1 M HEPES pH 7.5, 0.2 M MgCl2, 25% PEG3350 |
