9WAR
Open conformation of the EPSPS tetramer from Amaranthus retroflexus
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 | 2025-06-21 |
| Detector | DECTRIS EIGER2 X 4M |
| Wavelength(s) | 0.979183 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 162.857, 120.002, 93.023 |
| Unit cell angles | 90.00, 91.25, 90.00 |
Refinement procedure
| Resolution | 40.760 - 2.080 |
| R-factor | 0.2109 |
| Rwork | 0.209 |
| R-free | 0.24520 |
| Structure solution method | MIR |
| RMSD bond length | 0.003 |
| RMSD bond angle | 0.590 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.21.2_5419) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 93.000 | 2.190 |
| High resolution limit [Å] | 2.080 | 2.080 |
| Rmerge | 0.087 | 1.348 |
| Rmeas | 0.095 | 0.062 |
| Rpim | 0.036 | 0.032 |
| Number of reflections | 106016 | 15156 |
| <I/σ(I)> | 1 | 1 |
| Completeness [%] | 98.8 | 97.1 |
| Redundancy | 6.7 | 5.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.2 | 298 | Tacsimate pH=5.0,PEG 3350 |
