5CZT
Neisseria meningitidis 3 dexy-D-arabino-heptulosonate 7-phosphate synthase Glu176Ala variant
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX1 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX1 |
| Temperature [K] | 120 |
| Detector technology | CCD |
| Collection date | 2015-06-16 |
| Detector | ADSC QUANTUM 210r |
| Wavelength(s) | 0.954 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 75.647, 140.828, 77.266 |
| Unit cell angles | 90.00, 98.56, 90.00 |
Refinement procedure
| Resolution | 76.410 - 2.040 |
| R-factor | 0.17282 |
| Rwork | 0.171 |
| R-free | 0.20566 |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.391 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 76.410 | 2.080 |
| High resolution limit [Å] | 2.040 | 2.040 |
| Rmerge | 0.079 | 0.696 |
| Number of reflections | 101442 | |
| <I/σ(I)> | 18.6 | 2.6 |
| Completeness [%] | 99.9 | 98.7 |
| Redundancy | 7.6 | 7.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.3 | 296 | 0.1M Tris HCl (pH 7.3), 0.2 M trimethyl-amino-N-oxide (TMAO), 0.4 mM MnSO4 and PEG 2000MME |
