4LJ2
Crystal structure of chorismate synthase from Acinetobacter baumannii at 3.15A resolution
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE BM14 |
| Synchrotron site | ESRF |
| Beamline | BM14 |
| Temperature [K] | 77 |
| Detector technology | CCD |
| Collection date | 2013-05-01 |
| Detector | MARRESEARCH |
| Wavelength(s) | 0.97 |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 108.770, 72.610, 89.960 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 46.540 - 3.150 |
| R-factor | 0.225 |
| Rwork | 0.225 |
| R-free | 0.25200 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1r52 |
| RMSD bond length | 0.019 |
| RMSD bond angle | 2.300 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | AMoRE |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 46.540 | 3.240 |
| High resolution limit [Å] | 3.150 | 3.150 |
| Number of reflections | 12153 | |
| Completeness [%] | 99.7 | 96.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 298 | 50mM Tris-HCl, 0.2M MgCl2, 20% PEG3350, pH 8, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
