21LO

Crystal structure of Horse spleen L-ferritin mutant (L24G/S27G/E56F/R59G/E60F/E63F) with unsubstituted C60 Fullerene

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-E DW
Temperature [K]	93
Detector technology	PIXEL
Collection date	2023-10-05
Detector	RIGAKU HyPix-6000HE
Wavelength(s)	1.54184
Spacegroup name	F 4 3 2
Unit cell lengths	180.220, 180.220, 180.220
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	24.080 - 1.990
R-factor	0.1812
Rwork	0.179
R-free	0.22090
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	0.995
Data reduction software	CrysalisPro
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	24.080	2.040
High resolution limit [Å]	1.990	1.990
Rmerge	0.106	0.920
Rmeas	0.111	0.974
Rpim	0.030	0.314
Number of reflections	17758	1270
<I/σ(I)>	22.2	2.6
Completeness [%]	99.9	100
Redundancy	12.9	9.4
CC(1/2)	0.998	0.821

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8	293	Ammonium sulfate, Cadmium sulfate