8AMR

Coiled-coil domain of human TRIM3

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE MASSIF-1
Synchrotron site	ESRF
Beamline	MASSIF-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-04-21
Detector	DECTRIS PILATUS3 2M
Wavelength(s)	0.9655
Spacegroup name	P 41 21 2
Unit cell lengths	167.900, 167.900, 127.200
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.530 - 3.800
R-factor	0.2749
Rwork	0.273
R-free	0.32130
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	AlphaFold model of TRIM3 coiled coil
RMSD bond length	0.002
RMSD bond angle	0.421
Data reduction software	XDS (Jan 10, 2022)
Data scaling software	XDS (Jan 10, 2022)
Phasing software	PHENIX (1.20.1_4487)
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.530	3.840
High resolution limit [Å]	3.710	3.710
Rmerge	0.102	2.999
Number of reflections	19774	1921
<I/σ(I)>	19.26	1.15
Completeness [%]	99.6
Redundancy	25.6
CC(1/2)	1.000	0.586

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		280.15	0.2 M potassium thiocyanate, 20% (w/v) PEG 3350