8R4U
Structure of salt-inducible kinase 3 with inhibitors
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | MAX IV BEAMLINE BioMAX |
| Synchrotron site | MAX IV |
| Beamline | BioMAX |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-09-22 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.97625 |
| Spacegroup name | P 1 |
| Unit cell lengths | 63.074, 112.841, 127.118 |
| Unit cell angles | 66.32, 81.42, 90.10 |
Refinement procedure
| Resolution | 114.840 - 2.416 |
| R-factor | 0.2296 |
| Rwork | 0.228 |
| R-free | 0.26530 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.950 |
| Data reduction software | autoPROC |
| Data scaling software | STARANISO |
| Phasing software | PHASER |
| Refinement software | BUSTER (2.11.8) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 114.840 | 2.760 |
| High resolution limit [Å] | 2.416 | 2.450 |
| Number of reflections | 67135 | 3359 |
| <I/σ(I)> | 3.8 | |
| Completeness [%] | 57.7 | 9.5 |
| Redundancy | 1.9 | 1.9 |
| CC(1/2) | 0.985 | 0.725 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7.5 | 293 | 1.3 M LiSO4 and 0.1 M Hepes pH 7.2 |
