4OVD
Crystal structure of a putative peptidoglycan glycosyltransferase from Atopobium parvulum DSM 20469
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-F |
| Synchrotron site | APS |
| Beamline | 21-ID-F |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-10-21 |
| Detector | MARMOSAIC 225 mm CCD |
| Wavelength(s) | 0.97872 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 153.680, 45.510, 71.290 |
| Unit cell angles | 90.00, 102.78, 90.00 |
Refinement procedure
| Resolution | 29.170 - 2.000 |
| R-factor | 0.18223 |
| Rwork | 0.179 |
| R-free | 0.23269 |
| Structure solution method | SAD |
| RMSD bond length | 0.017 |
| RMSD bond angle | 2.107 |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0049) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 29.170 | 2.050 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.090 | 0.052 |
| Number of reflections | 32538 | |
| <I/σ(I)> | 9.8 | 2.5 |
| Completeness [%] | 99.0 | 95.6 |
| Redundancy | 5.6 | 5.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 293 | 0.2 M Calcium Chloride, 0.1 M HEPES, 20% PEG6000, pH 7, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
