4PB4
D-threo-3-hydroxyaspartate dehydratase H351A mutant complexed with 2-amino maleic acid
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 | 2013-02-16 |
| Detector | ADSC QUANTUM 210 |
| Wavelength(s) | 1.000 |
| Spacegroup name | I 41 2 2 |
| Unit cell lengths | 157.748, 157.748, 158.024 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 37.210 - 1.800 |
| R-factor | 0.16497 |
| Rwork | 0.164 |
| R-free | 0.18316 |
| RMSD bond length | 0.025 |
| RMSD bond angle | 2.216 |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.830 |
| High resolution limit [Å] | 1.800 | 1.800 |
| Rmerge | 0.094 | 0.672 |
| Number of reflections | 91233 | |
| <I/σ(I)> | 29.1 | 5.42 |
| Completeness [%] | 99.6 | 99.1 |
| Redundancy | 14.9 | 15 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | PEG3350, Tris-HCl. MgCl2 |
