4OXQ
Structure of Staphylococcus pseudintermedius metal-binding protein SitA in complex with Zinc
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06DA |
| Synchrotron site | SLS |
| Beamline | X06DA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2012-08-13 |
| Detector | DECTRIS PILATUS 2M-F |
| Wavelength(s) | 1.0 |
| Spacegroup name | I 1 2 1 |
| Unit cell lengths | 81.660, 58.170, 112.329 |
| Unit cell angles | 90.00, 101.76, 90.00 |
Refinement procedure
| Resolution | 51.420 - 2.620 |
| R-factor | 0.1793 |
| Rwork | 0.176 |
| R-free | 0.24740 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1psz |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.180 |
| Data reduction software | MOSFLM |
| Refinement software | BUSTER (2.11.4) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 51.400 | 2.720 |
| High resolution limit [Å] | 2.620 | 2.620 |
| Rmerge | 0.442 | |
| Number of reflections | 15736 | |
| <I/σ(I)> | 3.7 | 1.8 |
| Completeness [%] | 98.9 | 99.3 |
| Redundancy | 2.7 | 2.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 1,1,1,3,3,3-hexafluoro-2-propanol |
