6GO1
Crystal Structure of a Bacillus anthracis peptidoglycan deacetylase
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 | 2013-12-07 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 1.00 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 41.723, 211.795, 46.784 |
| Unit cell angles | 90.00, 91.82, 90.00 |
Refinement procedure
| Resolution | 45.661 - 2.590 |
| R-factor | 0.1864 |
| Rwork | 0.183 |
| R-free | 0.24530 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4v33 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.240 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 45.661 | 2.693 |
| High resolution limit [Å] | 2.589 | 2.589 |
| Number of reflections | 24772 | |
| <I/σ(I)> | 1.36 | |
| Completeness [%] | 98.6 | |
| Redundancy | 4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 289 | 150 mM lithium sulfate, 100 mM Tris HCl pH 8.0, 5 mM spermidine, 30% w/v PEG 4000 |
