4WBG
Crystal structure of class C beta-lactamase Mox-1 covalently complexed with aztorenam
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE AR-NE3A |
| Synchrotron site | Photon Factory |
| Beamline | AR-NE3A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2013-12-13 |
| Detector | ADSC QUANTUM 270 |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 49.540, 59.250, 62.480 |
| Unit cell angles | 90.00, 102.72, 90.00 |
Refinement procedure
| Resolution | 29.720 - 1.900 |
| R-factor | 0.17716 |
| Rwork | 0.175 |
| R-free | 0.21422 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.392 |
| Refinement software | REFMAC (5.8.0069) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 60.950 |
| High resolution limit [Å] | 1.900 |
| Rmerge | 0.079 |
| Number of reflections | 27737 |
| <I/σ(I)> | 7.75 |
| Completeness [%] | 99.4 |
| Redundancy | 6.77 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 289 | PEG8000, cacodylate, zinc acetate |
