5V5K

Crystal structure of ferritin E65R mutant from hyperthermophilic archaeon Archaeoglobus fulgidus

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL9-2
Synchrotron site	SSRL
Beamline	BL9-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-11-17
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.979
Spacegroup name	P 21 3
Unit cell lengths	171.730, 171.730, 171.730
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	99.148 - 3.080
R-factor	0.2646
Rwork	0.259
R-free	0.27050
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1s3q
RMSD bond length	0.009
RMSD bond angle	1.065
Data reduction software	MOSFLM
Data scaling software	Aimless (0.5.17)
Phasing software	PHASER
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	99.150	99.150	3.250
High resolution limit [Å]	3.080	9.740	3.080
Rmerge	0.167	0.054	1.056
Rpim	0.040
Number of reflections	31499
<I/σ(I)>	15
Completeness [%]	100.0	99.9	100
Redundancy	18	16.9	18.9
CC(1/2)	0.999	1.000	0.570

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.6	294	0.45 M potassium phosphate monobasic, 0.3 M sodium phosphate monobasic, 5% (v/v) glycerol