5LW3
Azotobacter vinelandii Mannuronan C-5 epimerase AlgE6 A-module
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID23-2 |
| Synchrotron site | ESRF |
| Beamline | ID23-2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-12-01 |
| Detector | DECTRIS PILATUS3 2M |
| Wavelength(s) | 0.8726 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 100.884, 63.672, 73.075 |
| Unit cell angles | 90.00, 97.16, 90.00 |
Refinement procedure
| Resolution | 44.617 - 1.190 |
| R-factor | 0.1446 |
| Rwork | 0.144 |
| R-free | 0.16030 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2pyg |
| RMSD bond length | 0.017 |
| RMSD bond angle | 1.620 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.9_1692) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.617 | 1.230 |
| High resolution limit [Å] | 1.190 | 1.190 |
| Rmerge | 0.685 | |
| Rmeas | 0.063 | 0.780 |
| Number of reflections | 146496 | |
| <I/σ(I)> | 12.31 | 1.8 |
| Completeness [%] | 99.8 | 99.7 |
| Redundancy | 4.5 | 4.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 9.5 | 295 | 100 mM BisTrisPropane pH 9.5, 15-30% PEG 8000 |
