6HDP
Human DYRK2 bound to Scorzodihydrostilbene A
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-01-15 |
Detector | ADSC QUANTUM 315 |
Wavelength(s) | 1.0 |
Spacegroup name | P 42 21 2 |
Unit cell lengths | 84.527, 84.527, 148.372 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 55.820 - 2.300 |
R-factor | 0.18635 |
Rwork | 0.184 |
R-free | 0.23776 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4azf |
RMSD bond length | 0.007 |
RMSD bond angle | 1.198 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | REFMAC |
Refinement software | REFMAC (5.8.0230) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 84.530 | 2.420 |
High resolution limit [Å] | 2.300 | 2.300 |
Rmerge | 0.093 | 0.837 |
Number of reflections | 24654 | 3523 |
<I/σ(I)> | 14.7 | 2.6 |
Completeness [%] | 100.0 | 100 |
Redundancy | 7 | 7.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 277 | 0.15M sodium malate and 20% PEG 3350 |