4JBF
Crystal structure of peptidoglycan glycosyltransferase from Atopobium parvulum DSM 20469.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-G |
| Synchrotron site | APS |
| Beamline | 21-ID-G |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-01-30 |
| Detector | MARMOSAIC 300 mm CCD |
| Wavelength(s) | 0.97856 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 66.927, 70.167, 114.820 |
| Unit cell angles | 90.00, 97.35, 90.00 |
Refinement procedure
| Resolution | 29.480 - 1.920 |
| R-factor | 0.19746 |
| Rwork | 0.195 |
| R-free | 0.23679 |
| Structure solution method | SAD |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.835 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHENIX |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.000 | 1.980 |
| High resolution limit [Å] | 1.920 | 1.950 |
| Rmerge | 0.124 | |
| Number of reflections | 77602 | |
| <I/σ(I)> | 14.2 | 2.75 |
| Completeness [%] | 99.8 | 99.9 |
| Redundancy | 3.8 | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 293 | 0.2 M Ammonium Chloride, 0.1 M HEPES pH 7, 20% PEG 6000, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
