6TSA

Crystal structure of human L ferritin (HuLf) Fe(III)-loaded for 30 minutes

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID29
Synchrotron site	ESRF
Beamline	ID29
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-12-12
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	1.07227
Spacegroup name	I 4 3 2
Unit cell lengths	152.690, 152.690, 152.690
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.280 - 2.180
Rwork	0.202
R-free	0.25750
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5lg8
RMSD bond length	0.014
RMSD bond angle	1.796
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0257)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	48.280	3.230	2.300
High resolution limit [Å]	2.180	3.060	2.180
Rmerge	0.122	1.500	1.573
Rmeas	0.128	1.565	1.641
Rpim	0.028	0.354	0.347
Number of reflections	16176	864	2300
<I/σ(I)>	13.6	2.1	2.2
Completeness [%]	100.0	100	100
Redundancy	21.3	19.5	22.1
CC(1/2)	0.999	0.837	0.839

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.6	293	80 mM cadmium nitrate, 80 mM ammonium sulfate, 200 mM sodium acetate, pH 4.6
1	VAPOR DIFFUSION, SITTING DROP	4.6	293	80 mM cadmium nitrate, 80 mM ammonium sulfate, 200 mM sodium acetate, pH 4.6
1	VAPOR DIFFUSION, SITTING DROP	4.6	293	80 mM cadmium nitrate, 80 mM ammonium sulfate, 200 mM sodium acetate, pH 4.6