7XZ4

Crystal structure of ferritin from Setaria italica

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL10U2
Synchrotron site	SSRF
Beamline	BL10U2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-10-25
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9785
Spacegroup name	I 4 3 2
Unit cell lengths	150.336, 150.336, 150.336
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.580 - 2.200
R-factor	0.1624
Rwork	0.158
R-free	0.20060
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6j4j
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.240
High resolution limit [Å]	2.200	5.970	2.200
Rmerge	0.567	0.078	1.660
Rmeas	0.573	0.079	1.706
Rpim	0.081	0.011	0.388
Number of reflections	27759	856	735
<I/σ(I)>	4.7
Completeness [%]	100.0	100	100
Redundancy	48.4	49.2	19.3
CC(1/2)		0.999	0.498

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		289	Ammonium dihydrogen phosphate 2.2M,Tris 0.1M, pH8.5