6YF8
DYRK1A with PST001
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | BESSY BEAMLINE 14.2 |
| Synchrotron site | BESSY |
| Beamline | 14.2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2018-05-08 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 0.918400 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 88.000, 88.040, 229.720 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.298 - 3.198 |
| R-factor | 0.2509 |
| Rwork | 0.249 |
| R-free | 0.28280 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4nct |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.753 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.14_3260: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 3.390 |
| High resolution limit [Å] | 3.198 | 3.198 |
| Rmeas | 0.290 | |
| Number of reflections | 30124 | 4745 |
| <I/σ(I)> | 7 | |
| Completeness [%] | 99.3 | |
| Redundancy | 6.66 | |
| CC(1/2) | 0.990 | 0.580 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.1 M KSCN; 0.05M LiCl; 10% PEG 3350, pH 6.8, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
