5H67
Crystal structure of the Bacillus subtilis SMC head domain complexed with the cognate ScpA C-terminal domain and soaked ATP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL26B1 |
| Synchrotron site | SPring-8 |
| Beamline | BL26B1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-02-01 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 1.0000 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 88.009, 47.124, 97.698 |
| Unit cell angles | 90.00, 112.59, 90.00 |
Refinement procedure
| Resolution | 40.627 - 2.072 |
| R-factor | 0.192361109808 |
| Rwork | 0.191 |
| R-free | 0.22203 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5h66 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.848 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.110 |
| High resolution limit [Å] | 2.070 | 2.070 |
| Rmerge | 0.039 | 0.244 |
| Number of reflections | 44563 | |
| <I/σ(I)> | 14.8 | |
| Completeness [%] | 98.4 | 86.7 |
| Redundancy | 3.5 | 2.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.4 | 277 | 3.5M sodium formate (pH 7.4), the crystals were soaked in the reservoir solution containing 10mM Mg-ATP |
