8XY5
Open conformation of Burkholderia stagnalis lipase
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | PHOTON FACTORY BEAMLINE AR-NW12A |
| Synchrotron site | Photon Factory |
| Beamline | AR-NW12A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2018-02-22 |
| Detector | ADSC QUANTUM 270 |
| Wavelength(s) | 1.0 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 160.643, 69.210, 51.322 |
| Unit cell angles | 90.00, 98.53, 90.00 |
Refinement procedure
| Resolution | 29.243 - 1.399 |
| R-factor | 0.163 |
| Rwork | 0.162 |
| R-free | 0.18380 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.003 |
| RMSD bond angle | 1.190 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0419) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.420 |
| High resolution limit [Å] | 1.399 | 1.399 |
| Rmerge | 0.835 | |
| Number of reflections | 109236 | 5480 |
| <I/σ(I)> | 24.5 | 1.8 |
| Completeness [%] | 99.8 | 99.9 |
| Redundancy | 3.6 | 3.4 |
| CC(1/2) | 0.996 | 0.627 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 7 | 277 | 0.1 M HEPES, pH 7.0, 45% MPD, 1 M ammonium fluoride, 3% methanol |
