4CJD
Crystal structure of Neisseria meningitidis trimeric autotransporter and vaccine antigen NadA
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 | 2012-08-15 |
| Detector | PILATUS PILATUS 2M |
| Spacegroup name | H 3 2 |
| Unit cell lengths | 51.227, 51.227, 577.942 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 48.162 - 2.056 |
| R-factor | 0.183 |
| Rwork | 0.182 |
| R-free | 0.20710 |
| Structure solution method | SAD |
| Starting model (for MR) | NONE |
| RMSD bond length | 0.014 |
| RMSD bond angle | 1.207 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((PHENIX.REFINE)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.100 | 2.180 |
| High resolution limit [Å] | 2.050 | 2.060 |
| Number of reflections | 34971 | |
| <I/σ(I)> | 22.75 | 2.18 |
| Completeness [%] | 99.2 | 95.4 |
| Redundancy | 9.4 | 6.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 4 | 10% TACSIMATE PH 4.0, 20% PEG 3350 |
