8S9K

Structure of dimeric FAM111A SPD S541A Mutant

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-E
Synchrotron site	APS
Beamline	24-ID-E
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-02-03
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97918
Spacegroup name	P 21 21 21
Unit cell lengths	74.814, 83.765, 191.120
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.500 - 2.720
R-factor	0.1956
Rwork	0.193
R-free	0.24950
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.516
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX ((1.17.1_3660: ???))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.800
High resolution limit [Å]	2.700	5.810	2.700
Rmerge	0.241	0.104	1.268
Rmeas	0.261	0.114	1.368
Rpim	0.099	0.044	0.507
Total number of observations	222382
Number of reflections	32772	3497	3223
<I/σ(I)>	3.7
Completeness [%]	99.8	99.7	100
Redundancy	6.8	6.4	7.1
CC(1/2)	0.978	0.991	0.523

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	293	20% w/v PEG8000, 100 mM Tris, 200 mM magnesium chloride