9J3V
Fe2+/Fe2+ PolF-L-isoleucine complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL19U1 |
| Synchrotron site | SSRF |
| Beamline | BL19U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-06-10 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.987 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 85.852, 120.876, 89.221 |
| Unit cell angles | 90.00, 91.51, 90.00 |
Refinement procedure
| Resolution | 24.740 - 2.600 |
| R-factor | 0.2296 |
| Rwork | 0.228 |
| R-free | 0.24810 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.216 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.19.2_4158: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 24.750 | 2.680 |
| High resolution limit [Å] | 2.600 | 2.600 |
| Rmerge | 0.093 | 0.932 |
| Rpim | 0.059 | 0.572 |
| Number of reflections | 55934 | 4553 |
| <I/σ(I)> | 13.1 | |
| Completeness [%] | 99.9 | |
| Redundancy | 6.8 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.2 M Lithium sulfate monohydrate 0.1 M HEPES (pH 7.3) 23% PEG3350 |
