5HWM
Crystal structure of keto-deoxy-D-galactarate dehydratase complexed with 2-oxoadipic acid
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04-1 |
| Synchrotron site | Diamond |
| Beamline | I04-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-08-12 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 0.987 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 169.520, 119.030, 74.280 |
| Unit cell angles | 90.00, 112.24, 90.00 |
Refinement procedure
| Resolution | 47.883 - 2.097 |
| R-factor | 0.2027 |
| Rwork | 0.199 |
| R-free | 0.27820 |
| RMSD bond length | 0.015 |
| RMSD bond angle | 1.509 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | PHENIX (dev_1803) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.900 | 2.150 |
| High resolution limit [Å] | 2.100 | 2.100 |
| Rmerge | 0.136 | 0.710 |
| Number of reflections | 76785 | |
| <I/σ(I)> | 8.4 | 2 |
| Completeness [%] | 96.0 | 92.8 |
| Redundancy | 3.5 | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 294 | BiCINE, sodium formate, PEG MME 5000 |
