2G5C
Crystal Structure of Prephenate Dehydrogenase from Aquifex aeolicus
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2005-01-01 |
| Detector | CUSTOM-MADE |
| Wavelength(s) | 0.9794 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 42.707, 178.952, 75.195 |
| Unit cell angles | 90.00, 99.15, 90.00 |
Refinement procedure
| Resolution | 29.930 - 1.900 |
| R-factor | 0.22 |
| Rwork | 0.220 |
| R-free | 0.26100 |
| Structure solution method | SAD |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.200 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | CNS |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 34.000 | 1.970 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.081 | |
| Number of reflections | 160792 | |
| <I/σ(I)> | 11.9 | 2.2 |
| Completeness [%] | 91.9 | 84.7 |
| Redundancy | 2.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 3.2 | 298 | 12% PEG 4000, 100mM sodium acetate, 200mM lithium sulfate, 2mM NAD , pH 3.2, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
