5HAQ
OXa-48 beta-lactamase mutant - S70G
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 5.0.1 |
| Synchrotron site | ALS |
| Beamline | 5.0.1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2015-04-29 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.997 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 72.660, 73.611, 106.360 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 60.000 - 2.140 |
| R-factor | 0.1854 |
| Rwork | 0.184 |
| R-free | 0.21130 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.893 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.10.1_2155) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 60.000 | 2.220 |
| High resolution limit [Å] | 2.140 | 2.140 |
| Rmerge | 0.050 | 0.320 |
| Number of reflections | 32095 | |
| <I/σ(I)> | 9.2 | 2.3 |
| Completeness [%] | 99.8 | 99.7 |
| Redundancy | 6.5 | 6.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 298 | 0.2M sodium formate, 0.1M cadmium chloride, and 25% w/v PEG 3350 |
