Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-09-02 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 1 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 119.660, 179.020, 234.550 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 98.000 - 3.200 |
| R-factor | 0.1913 |
| Rwork | 0.191 |
| R-free | 0.22669 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.022 |
| RMSD bond angle | 2.246 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0131) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 99.480 | 3.330 |
| High resolution limit [Å] | 3.200 | 3.200 |
| Rmerge | 0.191 | 0.944 |
| Rmeas | 0.227 | 1.129 |
| Rpim | 0.120 | 0.607 |
| Total number of observations | 141117 | 14486 |
| Number of reflections | 40961 | 4520 |
| <I/σ(I)> | 5 | 1.5 |
| Completeness [%] | 98.1 | |
| Redundancy | 3.4 | 3.2 |
| CC(1/2) | 0.975 | 0.380 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 6.5 | 293 | 100 mM N-(2-Acetamido)iminodiacetic acid (ADA) pH 6.5, 1.2 M Na/K Tartrate. Crystals were soaked in a solution containing 1 mM bomedemstat for 2 hours at 20 degress |
