6TAD
Bd0314 DslA E143Q mutant
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I03 |
| Synchrotron site | Diamond |
| Beamline | I03 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-05-20 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 1.77 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 48.111, 62.126, 80.929 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 49.280 - 1.822 |
| R-factor | 0.174 |
| Rwork | 0.172 |
| R-free | 0.21010 |
| Structure solution method | SAD |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.789 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.5.31) |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.10.1_2155) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 62.150 | 62.150 | 1.870 |
| High resolution limit [Å] | 1.820 | 8.150 | 1.820 |
| Rmerge | 0.162 | 0.118 | 0.638 |
| Rmeas | 0.164 | 0.119 | 0.682 |
| Rpim | 0.022 | 0.016 | 0.227 |
| Total number of observations | 968126 | 16275 | 2878 |
| Number of reflections | 19553 | 308 | 333 |
| <I/σ(I)> | 20.1 | 30.2 | 2.7 |
| Completeness [%] | 87.4 | 99.9 | 21.1 |
| Redundancy | 49.5 | 52.8 | 8.6 |
| CC(1/2) | 0.998 | 0.995 | 0.722 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 289 | 0.2M lithium sulphate 0.1M sodium citrate pH 5.5 20% PEG 3000 |
