8AAU
LIM Domain Kinase 1 (LIMK1) bound to LIMKi3
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I03 |
Synchrotron site | Diamond |
Beamline | I03 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2017-01-13 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.9795 |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 85.668, 85.668, 182.108 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 68.710 - 1.740 |
R-factor | 0.2128 |
Rwork | 0.211 |
R-free | 0.23990 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5nxd |
RMSD bond length | 0.010 |
RMSD bond angle | 1.078 |
Data reduction software | MOSFLM |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 68.710 | 1.800 |
High resolution limit [Å] | 1.740 | 1.740 |
Rmerge | 0.019 | 0.239 |
Number of reflections | 41448 | 4039 |
<I/σ(I)> | 16.7 | 2.4 |
Completeness [%] | 100.0 | 99.98 |
Redundancy | 2 | 2 |
CC(1/2) | 0.999 | 0.913 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 4.5 | 277 | 0.1 M acetate pH 4.5, 0.2 M lithium sulfate, 12% PEG8K |