1S9U
Atomic structure of a putative anaerobic dehydrogenase component
Experimental procedure
| Experimental method | MAD |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 19-ID |
| Synchrotron site | APS |
| Beamline | 19-ID |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2003-12-09 |
| Detector | SBC-2 |
| Wavelength(s) | 0.97945, 0.97929 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 85.401, 79.355, 43.470 |
| Unit cell angles | 90.00, 115.14, 90.00 |
Refinement procedure
| Resolution | 20.000 - 1.380 |
| R-factor | 0.16253 |
| Rwork | 0.161 |
| R-free | 0.18527 |
| Structure solution method | MAD |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.396 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | SOLVE |
| Refinement software | REFMAC (5.1.24) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.450 |
| High resolution limit [Å] | 1.400 | 1.400 |
| Rmerge | 0.040 | 0.290 |
| Number of reflections | 85983 | |
| <I/σ(I)> | 1.56 | |
| Completeness [%] | 96.5 | 32.5 |
| Redundancy | 4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 298 | PEG 300, ammonium sulfate, imidazole, glycerol, pH 8, VAPOR DIFFUSION, HANGING DROP, temperature 298K |
