8CM5
W-formate dehydrogenase C872A from Desulfovibrio vulgaris
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID30B |
| Synchrotron site | ESRF |
| Beamline | ID30B |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-03-03 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.9763 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 73.440, 261.055, 126.209 |
| Unit cell angles | 90.00, 90.58, 90.00 |
Refinement procedure
| Resolution | 48.831 - 2.150 |
| Rwork | 0.184 |
| R-free | 0.23960 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.670 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.831 | 2.190 |
| High resolution limit [Å] | 2.150 | 2.150 |
| Number of reflections | 248226 | 12361 |
| <I/σ(I)> | 6.7 | |
| Completeness [%] | 96.8 | |
| Redundancy | 2.3 | |
| CC(1/2) | 0.998 | 0.453 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 20% PEG 3350 (w/v), 0.1 M Tris-HCl pH 8.5 and 0.2 M CaCl2 |
