8XVN
Short-chain dehydrogenase/reductase6 (SDR6) from Antrodia camphorata
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL02U1 |
| Synchrotron site | SSRF |
| Beamline | BL02U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-07-21 |
| Detector | DECTRIS EIGER2 S 9M |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 68.410, 133.460, 94.221 |
| Unit cell angles | 90.00, 91.03, 90.00 |
Refinement procedure
| Resolution | 39.124 - 2.000 |
| R-factor | 0.1654 |
| Rwork | 0.164 |
| R-free | 0.19230 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.016 |
| RMSD bond angle | 1.823 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Refinement software | PHENIX ((1.16_3549: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 55.840 | 2.030 |
| High resolution limit [Å] | 2.000 | 2.000 |
| Rmerge | 0.082 | 0.216 |
| Rmeas | 0.089 | 0.279 |
| Rpim | 0.034 | 0.174 |
| Total number of observations | 578069 | 8099 |
| Number of reflections | 102389 | 4113 |
| <I/σ(I)> | 13.1 | 3.1 |
| Completeness [%] | 89.9 | |
| Redundancy | 5.6 | 2 |
| CC(1/2) | 0.997 | 0.884 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 289 | 0.1M Sodium malonate pH 5.0, 12% w/v Polyethylene glycol 3350 |
