3HR7
Crystal structure of the shikimate kinase-sulfate complex from Helicobacter pylori
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSRRC BEAMLINE BL13B1 |
| Synchrotron site | NSRRC |
| Beamline | BL13B1 |
| Temperature [K] | 123 |
| Detector technology | CCD |
| Collection date | 2005-10-10 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 1.0000 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 122.483, 59.613, 80.757 |
| Unit cell angles | 90.00, 113.08, 90.00 |
Refinement procedure
| Resolution | 30.000 - 1.800 |
| R-factor | 0.22842 |
| Rwork | 0.227 |
| R-free | 0.25972 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1zuh |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.546 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.5.0062) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 74.330 | |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.068 | |
| Number of reflections | 49284 | |
| Completeness [%] | 98 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7 | 293 | 30% PEG 8000, 0.2M lithium sulphate, 0.1M sodium acetate buffer, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 293K |
