3S95
Crystal structure of the human LIMK1 kinase domain in complex with staurosporine
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 | 2011-04-25 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 0.9763 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 106.160, 128.000, 131.350 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 40.860 - 1.650 |
| R-factor | 0.15673 |
| Rwork | 0.155 |
| R-free | 0.18084 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1YI6 and 2QO9 |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.557 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.5.0110) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.780 | 1.740 |
| High resolution limit [Å] | 1.650 | 1.650 |
| Rmerge | 0.068 | 0.608 |
| Number of reflections | 105524 | |
| <I/σ(I)> | 11 | 2.2 |
| Completeness [%] | 98.7 | 98.5 |
| Redundancy | 4.1 | 4.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.2 | 293.15 | 24% MPD, 0.1M Tris pH 7.2, 10mM Phenol, VAPOR DIFFUSION, SITTING DROP, temperature 293.15K |
