8D0J

Apo Human SARM1 TIR domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.1
Synchrotron site	ALS
Beamline	5.0.1
Temperature [K]	93
Detector technology	PIXEL
Collection date	2019-08-17
Detector	DECTRIS PILATUS 6M
Wavelength(s)	1.11584
Spacegroup name	P 21 21 21
Unit cell lengths	33.080, 78.169, 116.137
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.610 - 1.940
R-factor	0.181
Rwork	0.177
R-free	0.22690
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	Homology model
RMSD bond length	0.008
RMSD bond angle	0.783
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.610	1.990
High resolution limit [Å]	1.940	1.940
Rmerge	0.138
Rmeas	0.150
Rpim	0.058
Number of reflections	23100	2248
<I/σ(I)>	13.6
Completeness [%]	100.0	100
Redundancy	12.4	10.2
CC(1/2)	0.998	0.682

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298.15	100 mM Bis-Tris propane pH 6.5, 200 mM potassium thiocyanate, and 15% polyethylene glycol 3350