9UCH
Crystal Structure of adenine-sulfotransferase from Bos Taurus
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SEALED TUBE |
| Source details | BRUKER D8 QUEST |
| Temperature [K] | 288.15 |
| Detector technology | PIXEL |
| Collection date | 2023-06-15 |
| Detector | Bruker PHOTON II |
| Wavelength(s) | 1.542 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 50.480, 87.434, 263.830 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 43.970 - 3.390 |
| R-factor | 0.2509 |
| Rwork | 0.248 |
| R-free | 0.30408 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.329 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | MOLREP |
| Refinement software | PHENIX (1.20.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.970 | 3.660 |
| High resolution limit [Å] | 3.390 | 3.390 |
| Rmerge | 0.178 | 0.708 |
| Rmeas | 0.200 | 0.798 |
| Rpim | 0.090 | 0.360 |
| Number of reflections | 8422 | 7925 |
| <I/σ(I)> | 7.1 | 2 |
| Completeness [%] | 99.6 | |
| Redundancy | 4.6 | |
| CC(1/2) | 0.991 | 0.642 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 289.15 | 1.5 M ammonium sulfate, 0.1 M Tris (pH 8.5), 12% glycerol |
