8HLT
The co-crystal structure of DYRK2 with YK-2-99B
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL18U1 |
Synchrotron site | SSRF |
Beamline | BL18U1 |
Temperature [K] | 289.15 |
Detector technology | PIXEL |
Collection date | 2022-07-31 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.979 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 129.820, 60.670, 155.340 |
Unit cell angles | 90.00, 113.08, 90.00 |
Refinement procedure
Resolution | 47.850 - 2.800 |
R-factor | 0.2131 |
Rwork | 0.209 |
R-free | 0.26690 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 1.255 |
Data reduction software | HKL-2000 |
Data scaling software | XDS |
Phasing software | PHASER |
Refinement software | PHENIX (19.0) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.850 | 2.810 |
High resolution limit [Å] | 2.740 | 2.740 |
Rmerge | 0.122 | 1.017 |
Rmeas | 0.132 | 1.098 |
Rpim | 0.051 | 0.410 |
Total number of observations | 198388 | 14840 |
Number of reflections | 29520 | 2126 |
<I/σ(I)> | 9.9 | 2 |
Completeness [%] | 99.8 | |
Redundancy | 6.7 | 7 |
CC(1/2) | 0.996 | 0.871 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 289.15 | 0.05M HEPES pH7.0, 12%PEG 3350, 1% Trptone, 1mM NaN3 |