7TIF

2.85 Angstroem crystal structure of Arginyltransferase 1 (ATE1) from Saccharomyces cerevisiae

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-F
Synchrotron site	APS
Beamline	21-ID-F
Temperature [K]	100
Detector technology	CCD
Collection date	2020-10-06
Detector	RAYONIX MX-300
Wavelength(s)	0.97872
Spacegroup name	P 43
Unit cell lengths	235.270, 235.270, 171.100
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	65.250 - 2.850
R-factor	0.2027
Rwork	0.200
R-free	0.25710
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	AlphaFold
RMSD bond length	0.010
RMSD bond angle	1.233
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHASER
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	68.230	2.952
High resolution limit [Å]	2.850	2.850
Number of reflections	216864	21570
<I/σ(I)>	11.1
Completeness [%]	100.0
Redundancy	7.7
CC(1/2)	0.997	0.330

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	2.0 M ammonium sulfate, 2.5 % isopropanol, 1 mM dithiotreitol