9FT6
Crystal structure of human DYRK1A in complex with ARN25697
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ELETTRA BEAMLINE 11.2C |
| Synchrotron site | ELETTRA |
| Beamline | 11.2C |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2022-02-18 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.00 |
| Spacegroup name | P 42 |
| Unit cell lengths | 93.810, 93.810, 48.980 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 66.330 - 3.000 |
| R-factor | 0.2095 |
| Rwork | 0.207 |
| R-free | 0.24970 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.494 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.19.2_4158: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 66.334 | 2.958 |
| High resolution limit [Å] | 2.907 | 2.907 |
| Rpim | 0.045 | 0.404 |
| Number of reflections | 9598 | 483 |
| <I/σ(I)> | 13.7 | 2.1 |
| Completeness [%] | 100.0 | |
| Redundancy | 12.3 | |
| CC(1/2) | 0.997 | 0.696 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 6.4 | 293 | 15-20% PEG1000, 50 mM Mes 6.4, 100 mM KCl |
