5KSR
Stationary phase survival protein E (SurE) from Xylella fastidiosa - XFSurE-TB (Tetramer Bigger).
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | LNLS BEAMLINE W01B-MX2 |
| Synchrotron site | LNLS |
| Beamline | W01B-MX2 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2008-07-15 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 1.459 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 172.336, 84.170, 87.310 |
| Unit cell angles | 90.00, 96.62, 90.00 |
Refinement procedure
| Resolution | 43.248 - 1.960 |
| R-factor | 0.1985 |
| Rwork | 0.196 |
| R-free | 0.23760 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3ty2 |
| RMSD bond length | 0.018 |
| RMSD bond angle | 1.524 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER (2.3.0) |
| Refinement software | PHENIX (1.8.2_1309) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.248 | 2.020 |
| High resolution limit [Å] | 1.960 | 1.960 |
| Rmerge | 0.049 | 0.338 |
| Number of reflections | 88536 | |
| <I/σ(I)> | 17.27 | 4.8 |
| Completeness [%] | 99.5 | 95.7 |
| Redundancy | 4.77 | 4.34 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.1 M bis-tris propane pH 7.5, 0.14 M Sodium iodide, 20% (W/V) PEG 3350, 5 mM dithiotheitol and 0.1 manganese II chloride. |
