6M5H
A class C beta-lactamase mutant - Y150F
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE BL-5A |
| Synchrotron site | Photon Factory |
| Beamline | BL-5A |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-06-23 |
| Detector | DECTRIS PILATUS3 S 6M |
| Wavelength(s) | 0.90 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 130.150, 59.980, 55.100 |
| Unit cell angles | 90.00, 111.31, 90.00 |
Refinement procedure
| Resolution | 32.990 - 1.200 |
| Rwork | 0.177 |
| R-free | 0.20660 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6k8x |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.146 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.18) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 4.390 |
| High resolution limit [Å] | 0.980 | 0.980 |
| Number of reflections | 430004 | 30255 |
| <I/σ(I)> | 6.54 | |
| Completeness [%] | 96.7 | |
| Redundancy | 3.35 | |
| CC(1/2) | 0.061 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | MICROBATCH | 295 | 30% polyethylene glycol 1500, 0.1M sodium cacodylate (pH 5.5), 0.2M sodium chloride |
