7F8D
Malate Dehydrogenase from Geobacillus stearothermophilus (gs-MDH) G218Y mutant
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SPRING-8 BEAMLINE BL26B1 |
| Synchrotron site | SPring-8 |
| Beamline | BL26B1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-05-21 |
| Detector | DECTRIS EIGER X 4M |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 77.424, 110.220, 150.827 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 48.509 - 2.400 |
| Rwork | 0.179 |
| R-free | 0.25790 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7by8 |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.561 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0266) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.510 | 2.470 |
| High resolution limit [Å] | 2.400 | 2.400 |
| Rmerge | 0.091 | 0.390 |
| Number of reflections | 51272 | 4381 |
| <I/σ(I)> | 21.6 | 7.7 |
| Completeness [%] | 100.0 | |
| Redundancy | 13.5 | |
| CC(1/2) | 0.999 | 0.973 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 20 mM Tris-HCl (pH 7.0), 12% PEG 8000, 0.2 M magnesium chloride, 2 mM oxaloacetic acid, 2 mM NAD |
