6FX8
The X-ray structure of the ferritin nanocage containing Au and Pt, obtained upon encapsulation of a single heterobimetallic compound within the protein cage (rotating anode data)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-06-08 |
Detector | RIGAKU SATURN 944 |
Wavelength(s) | 1.5418 |
Spacegroup name | F 4 3 2 |
Unit cell lengths | 180.832, 180.832, 180.832 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 104.400 - 1.800 |
R-factor | 0.16542 |
Rwork | 0.164 |
R-free | 0.19745 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5erk |
RMSD bond length | 0.044 |
RMSD bond angle | 2.076 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 104.400 | 1.830 |
High resolution limit [Å] | 1.800 | 1.800 |
Rmerge | 0.104 | 0.717 |
Rpim | 0.052 | 0.402 |
Number of reflections | 24060 | |
<I/σ(I)> | 18.4 | 2 |
Completeness [%] | 99.8 | 98 |
Redundancy | 8.7 | 4.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 7.4 | 298 | 0.6 M ammonium sulfate 0.1 M Tris HCl pH 7.4 60 mM cadmium sulfate |