6UH8
Crystal structure of DAD2 N242I mutant
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 | 2017-02-25 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.953736 |
| Spacegroup name | P 65 |
| Unit cell lengths | 133.736, 133.736, 99.764 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 45.810 - 1.580 |
| R-factor | 0.1399 |
| Rwork | 0.138 |
| R-free | 0.16490 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4dnp |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.740 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.5.31) |
| Phasing software | PHASER (2.7.17) |
| Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 45.860 | 45.810 | 1.610 |
| High resolution limit [Å] | 1.580 | 8.650 | 1.580 |
| Rmerge | 0.088 | 0.035 | 2.188 |
| Rmeas | 0.090 | 0.036 | 2.248 |
| Rpim | 0.021 | 0.009 | 0.517 |
| Total number of observations | 16039 | 128779 | |
| Number of reflections | 138411 | 891 | 6818 |
| <I/σ(I)> | 20.3 | 72.2 | 1.6 |
| Completeness [%] | 100.0 | 99.4 | 100 |
| Redundancy | 19.1 | 18 | 18.9 |
| CC(1/2) | 1.000 | 1.000 | 0.728 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 293 | 0.1M MES pH 6.5 1.58-1.72 M MgSO4 |
