9RGJ
X-ray structure of a polyoxidovanadate/human H-ferritin adduct obtained when the protein is treated 24 h with [VIVO(acac)2]
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ELETTRA BEAMLINE 11.2C |
| Synchrotron site | ELETTRA |
| Beamline | 11.2C |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2024-11-21 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.00 |
| Spacegroup name | F 4 3 2 |
| Unit cell lengths | 183.710, 183.710, 183.710 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 92.024 - 1.498 |
| Rwork | 0.163 |
| R-free | 0.19580 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.013 |
| RMSD bond angle | 2.117 |
| Data reduction software | autoPROC |
| Data scaling software | autoPROC |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 92.024 | 1.520 |
| High resolution limit [Å] | 1.498 | 1.500 |
| Rmerge | 0.200 | |
| Number of reflections | 40254 | 1692 |
| <I/σ(I)> | 20.9 | |
| Completeness [%] | 93.4 | 81.1 |
| Redundancy | 68.1 | 48.7 |
| CC(1/2) | 0.999 | 0.326 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 9 | 293 | 2.0 M MAGNESIUM CHLORIDE, 0.1 M bicine buffer pH 9.0 |
