3ZDU
Crystal structure of the human CDKL3 kinase domain
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04 |
Synchrotron site | Diamond |
Beamline | I04 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2012-10-29 |
Detector | ADSC CCD |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 63.930, 63.930, 163.630 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 45.890 - 2.200 |
R-factor | 0.21662 |
Rwork | 0.214 |
R-free | 0.26248 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | ENSEMBLE OF PDB ENTRIES 4AGU AND 4AAA |
RMSD bond length | 0.013 |
RMSD bond angle | 1.510 |
Data reduction software | MOSFLM |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 54.540 | 2.270 |
High resolution limit [Å] | 2.200 | 2.200 |
Rmerge | 0.100 | 0.630 |
Number of reflections | 20446 | |
<I/σ(I)> | 10.7 | 2.5 |
Completeness [%] | 99.9 | 100 |
Redundancy | 5.2 | 2.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 0.03M ZN CL, 30% PEG_6000, 5% ETHYLENE GLYCOL, MES PH5.5 |