4GVH
Crystal structure of Salmonella typhimurium family 3 glycoside hydrolase (NagZ) covalently bound to 5-fluoro-GlcNAc.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | CLSI BEAMLINE 08ID-1 |
| Synchrotron site | CLSI |
| Beamline | 08ID-1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2010-03-19 |
| Detector | RAYONIX MX-300 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 49.260, 65.923, 94.724 |
| Unit cell angles | 90.00, 99.28, 90.00 |
Refinement procedure
| Resolution | 48.620 - 1.450 |
| R-factor | 0.166 |
| Rwork | 0.165 |
| R-free | 0.19500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.078 |
| Data reduction software | XDS |
| Data scaling software | SCALA |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((phenix.refine: 1.7.2_869)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.620 | 1.530 |
| High resolution limit [Å] | 1.450 | 1.450 |
| Rmerge | 0.061 | 0.366 |
| Number of reflections | 105508 | |
| <I/σ(I)> | 14.4 | 3.9 |
| Completeness [%] | 99.5 | 96.7 |
| Redundancy | 4.1 | 3.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6.5 | 296 | 0.1 M MES, 25% PEG 1000, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 296K |
