9W28

Structure of Au3+ bound to human heavy chain ferritin nanocage.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL02U1
Synchrotron site	SSRF
Beamline	BL02U1
Temperature [K]	283
Detector technology	PIXEL
Collection date	2023-07-02
Detector	DECTRIS EIGER2 S 9M
Wavelength(s)	0.979183
Spacegroup name	F 4 3 2
Unit cell lengths	183.843, 183.843, 183.843
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	41.110 - 1.520
Rwork	0.205
R-free	0.21500
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
Data reduction software	DIALS
Data scaling software	DIALS
Phasing software	PHASER
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	41.110	1.574
High resolution limit [Å]	1.520	1.520
Rmerge	0.225	1.771
Number of reflections	41405	4081
<I/σ(I)>	18.83
Completeness [%]	99.9	100
Redundancy	72.6
CC(1/2)	0.999	0.915

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		283	2 M MgCl2, 0.1 M Bicine, pH 9.0