29KI
Spinach Ferredoxin I, Reduced, -400 mV
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I24 |
| Synchrotron site | Diamond |
| Beamline | I24 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2026-02-23 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.6199 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 30.020, 51.550, 61.090 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 30.550 - 1.110 |
| R-factor | 0.1668 |
| Rwork | 0.166 |
| R-free | 0.19430 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.024 |
| Data reduction software | DIALS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.21.2_5419) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.550 | 1.130 |
| High resolution limit [Å] | 1.110 | 1.110 |
| Rmerge | 0.076 | 1.490 |
| Rpim | 0.022 | 0.719 |
| Number of reflections | 470734 | 2948 |
| <I/σ(I)> | 12.4 | 0.7 |
| Completeness [%] | 99.7 | 100 |
| Redundancy | 8 | 5.2 |
| CC(1/2) | 0.999 | 0.489 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | BATCH MODE | 7.8 | 277 | 3.5M Ammonium Sulfate, 0.1M Sodium phosphate pH 7.8, 5% Glycerol |
