3T9Q
Structure of the Phosphatase Domain of the Cell Fate Determinant SpoIIE from Bacillus subtilis (Mn presoaked)
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID14-4 |
| Synchrotron site | ESRF |
| Beamline | ID14-4 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-03-07 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.93930 |
| Spacegroup name | P 61 2 2 |
| Unit cell lengths | 86.014, 86.014, 322.471 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 43.580 - 2.760 |
| R-factor | 0.22802 |
| Rwork | 0.224 |
| R-free | 0.29965 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3t91 |
| RMSD bond length | 0.020 |
| RMSD bond angle | 2.001 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.6.0086) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.810 |
| High resolution limit [Å] | 2.760 | 2.760 |
| Rmerge | 0.066 | 0.394 |
| Number of reflections | 19173 | |
| <I/σ(I)> | 64.2 | 7.7 |
| Completeness [%] | 99.5 | 94.8 |
| Redundancy | 16.8 | 16.1 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293 | 0.9 - 1.2 M sodium acetate and 0.1 M HEPES, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
