8WL4
The structure of D-mandelate dehydrogenase with L103G and T143G mutations
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NFPSS BEAMLINE BL18U |
| Synchrotron site | NFPSS |
| Beamline | BL18U |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-03-14 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.9786 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 82.620, 131.990, 58.640 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 44.960 - 2.550 |
| R-factor | 0.24834 |
| Rwork | 0.246 |
| R-free | 0.29449 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.132 |
| Data reduction software | XDS |
| Data scaling software | HKL-3000 |
| Phasing software | HKL-3000 |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 44.960 | 2.660 |
| High resolution limit [Å] | 2.550 | 2.550 |
| Number of reflections | 19800 | 19800 |
| <I/σ(I)> | 9.7 | |
| Completeness [%] | 96.8 | |
| Redundancy | 2.5 | |
| CC(1/2) | 0.996 | 0.996 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 289.15 | 0.4 M NaCl, 0.05M Tris pH 8.5, 25% Polyethylene glycol 3350 |
