6LBC

shrimp ferritin-T158R

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-06-16
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.9785
Spacegroup name	I 4
Unit cell lengths	124.783, 124.783, 175.395
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.460 - 1.801
R-factor	0.1952
Rwork	0.195
R-free	0.22540
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6a4u
RMSD bond length	0.006
RMSD bond angle	0.770
Data scaling software	HKL-2000
Refinement software	PHENIX (1.10.1_2155)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.860
High resolution limit [Å]	1.800	3.880	1.800
Rmerge	0.148	0.070	0.927
Rmeas	0.160	0.076	1.004
Rpim	0.061	0.029	0.385
Total number of observations	839727
Number of reflections	123173	12426	12249
<I/σ(I)>	3.7
Completeness [%]	100.0	100	100
Redundancy	6.8	6.8	6.7
CC(1/2)		0.995	0.626

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	8.5	293.15	0.1 M Tris pH 8.5, 2.0 M Ammonium sulfate