5BY5
High resolution structure of the ectoine synthase from the cold-adapted marine bacterium Sphingopyxis alaskensis
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID29 |
| Synchrotron site | ESRF |
| Beamline | ID29 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-11-12 |
| Detector | MAR CCD 165 mm |
| Wavelength(s) | 0.97625 |
| Spacegroup name | P 32 2 1 |
| Unit cell lengths | 72.710, 72.710, 52.330 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 19.400 - 1.200 |
| R-factor | 0.12456 |
| Rwork | 0.124 |
| R-free | 0.14929 |
| RMSD bond length | 0.019 |
| RMSD bond angle | 2.187 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 19.400 |
| High resolution limit [Å] | 1.200 |
| Number of reflections | 49094 |
| <I/σ(I)> | 21.94 |
| Completeness [%] | 97.8 |
| Redundancy | 7.6 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION | 285 | 0.05 M calcium acetate, 0.1 M sodium acetate pH 6, 40% (v/v) 1,2-propanediol |
