8A2M
X-ray structure of Ru(bpy)3]2+ complex (Ru1)-encapsulated human heavy chain ferritin
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 | 2022-03-25 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.96 |
| Spacegroup name | F 4 3 2 |
| Unit cell lengths | 183.770, 183.770, 183.770 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 105.622 - 1.570 |
| Rwork | 0.160 |
| R-free | 0.19040 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 5n27 |
| RMSD bond length | 0.013 |
| RMSD bond angle | 1.774 |
| Data reduction software | autoPROC |
| Data scaling software | autoPROC |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 106.100 | 1.590 |
| High resolution limit [Å] | 1.570 | 1.570 |
| Rmerge | 0.200 | 1.000 |
| Rmeas | 0.250 | 0.900 |
| Rpim | 0.030 | 0.380 |
| Number of reflections | 37411 | 1836 |
| <I/σ(I)> | 15 | |
| Completeness [%] | 99.4 | 100 |
| Redundancy | 20 | 15 |
| CC(1/2) | 0.998 | 0.846 |
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 |
