5IU1
N-terminal PAS domain homodimer of PpANR MAP3K from Physcomitrella patens.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I24 |
| Synchrotron site | Diamond |
| Beamline | I24 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-05-16 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.9686 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 85.148, 64.930, 51.850 |
| Unit cell angles | 90.00, 121.40, 90.00 |
Refinement procedure
| Resolution | 40.160 - 1.700 |
| R-factor | 0.16279 |
| Rwork | 0.161 |
| R-free | 0.19847 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3lyx |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.613 |
| Data reduction software | xia2 (v0.3.8.0) |
| Data scaling software | Aimless (v0.5.1) |
| Phasing software | PHASER (v2.5.7) |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.170 | 1.730 |
| High resolution limit [Å] | 1.700 | 1.700 |
| Rmerge | 0.059 | 0.387 |
| Number of reflections | 26146 | |
| <I/σ(I)> | 12 | 2.4 |
| Completeness [%] | 98.9 | 91.7 |
| Redundancy | 3.7 | 2.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 290 | 2% PEG 500, 0.1M Tris base, 2.5M Li2SO4 |
