5DMZ
Structure of human Bub1 kinase domain phosphorylated at Ser969
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-09-12 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 62.380, 66.340, 106.540 |
| Unit cell angles | 90.00, 98.34, 90.00 |
Refinement procedure
| Resolution | 43.304 - 2.400 |
| R-factor | 0.2122 |
| Rwork | 0.210 |
| R-free | 0.24510 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3E7E |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.853 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER (v6.2.0) |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 56.100 | 2.470 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Rmerge | 0.110 | 2.400 |
| Number of reflections | 33866 | |
| <I/σ(I)> | 10.99 | 1 |
| Completeness [%] | 99.8 | 99.8 |
| Redundancy | 6.9 | 6.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.6 | 277 | 0.2 M NaCl, 15% PEG 3350 |
