5UIT
Crystal structure of IRAK4 in complex with compound 14
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 17-ID |
| Synchrotron site | APS |
| Beamline | 17-ID |
| Temperature [K] | 173 |
| Detector technology | PIXEL |
| Collection date | 2015-01-01 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 1 |
| Spacegroup name | I 2 2 2 |
| Unit cell lengths | 91.140, 118.580, 139.630 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 59.290 - 1.840 |
| R-factor | 0.1828 |
| Rwork | 0.181 |
| R-free | 0.21800 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.020 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.9.6) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 90.380 |
| High resolution limit [Å] | 1.840 |
| Number of reflections | 59046 |
| <I/σ(I)> | 17.8 |
| Completeness [%] | 90.2 |
| Redundancy | 5.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 295 | 1.6-1.8 M Ammonium Citrate, pH7.0 |
