9X2J
AARS1 bound with Gly-SA.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL10U2 |
| Synchrotron site | SSRF |
| Beamline | BL10U2 |
| Temperature [K] | 293 |
| Detector technology | PIXEL |
| Collection date | 2025-05-24 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.97918 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 110.477, 67.846, 75.429 |
| Unit cell angles | 90.00, 127.39, 90.00 |
Refinement procedure
| Resolution | 59.930 - 1.930 |
| R-factor | 0.1897 |
| Rwork | 0.188 |
| R-free | 0.22420 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.036 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASES |
| Refinement software | PHENIX ((1.20.1_4487: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 59.930 | 1.990 |
| High resolution limit [Å] | 1.930 | 1.930 |
| Rmerge | 0.086 | 0.876 |
| Number of reflections | 32935 | 2830 |
| <I/σ(I)> | 10.51 | |
| Completeness [%] | 98.2 | |
| Redundancy | 3.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 293 | 0.1 M Bicine (pH 9.0), 2% (v/v) 1,4-dioxane, and 10% (w/v) polyethylene glycol 20,000 |
