8HS6
Brucella melitensis 7-alpha-Hydroxysteroid Dehydrogenase mutant:1-53 truncation
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U |
| Synchrotron site | SSRF |
| Beamline | BL17U |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-07-12 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.9875 |
| Spacegroup name | P 1 |
| Unit cell lengths | 89.077, 99.914, 103.422 |
| Unit cell angles | 87.43, 78.84, 78.37 |
Refinement procedure
| Resolution | 23.750 - 2.350 |
| R-factor | 0.2194 |
| Rwork | 0.217 |
| R-free | 0.26620 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.921 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((1.20.1_4487: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 23.850 | 2.430 |
| High resolution limit [Å] | 2.350 | 2.350 |
| Rmerge | 0.125 | |
| Number of reflections | 133130 | 142286 |
| <I/σ(I)> | 7.1 | |
| Completeness [%] | 99.1 | |
| Redundancy | 3.5 | |
| CC(1/2) | 0.987 | 0.895 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 289 | 6.0 M Ammonium nitrate, 0.1 M BIS-TRIS propane |
