9BR7

Crystal structure of human succinyl-CoA:glutarate-CoA transferase (SUGCT) in complex with Losartan carboxylic acid

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-1
Synchrotron site	NSLS-II
Beamline	17-ID-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-11-08
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.920105
Spacegroup name	P 21 21 21
Unit cell lengths	107.933, 119.809, 136.246
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	34.060 - 2.080
R-factor	0.2214
Rwork	0.220
R-free	0.24730
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.476
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	34.310	2.120
High resolution limit [Å]	2.080	2.080
Rmerge	0.134	1.882
Rmeas	0.150	2.101
Rpim	0.067	0.923
Total number of observations	513724	26323
Number of reflections	106315	5254
<I/σ(I)>	6.8	0.9
Completeness [%]	99.8
Redundancy	4.8	5
CC(1/2)	0.997	0.420

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		300	0.2 M Ammonium sulfate, 0.1 M BIS-TRIS pH 6.5, 25% w/v Polyethylene glycol 3,350