5TGF
Crystal structure of putative beta-lactamase from Bacteroides dorei DSM 17855
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2016-05-17 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.9794 |
| Spacegroup name | P 1 |
| Unit cell lengths | 63.475, 68.292, 88.216 |
| Unit cell angles | 103.84, 106.28, 101.20 |
Refinement procedure
| Resolution | 40.000 - 1.810 |
| R-factor | 0.15405 |
| Rwork | 0.152 |
| R-free | 0.19349 |
| Structure solution method | SAD |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.330 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | SHELXCD |
| Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 40.000 | 1.830 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.104 | 0.590 |
| Number of reflections | 111659 | |
| <I/σ(I)> | 11 | |
| Completeness [%] | 92.4 | 93.9 |
| Redundancy | 3.9 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 6 | 291 | 20% (w/v) PEG 8000 0.1 M MES:NaOH pH 6 0.2 M Calcium Acetate |
