9S5I

anammox-specific heterodimeric ketoacyl-ACP synthase (amxFabFhet) from Brocadia fulgida in complex with its anammox-specific acyl carrier protein (amxACP)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-1
Synchrotron site	ESRF
Beamline	ID23-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-09-13
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.8856
Spacegroup name	P 21 21 2
Unit cell lengths	122.596, 163.211, 101.660
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	67.930 - 2.070
R-factor	0.1887
Rwork	0.187
R-free	0.22200
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.622
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	68.000	2.150
High resolution limit [Å]	2.070	2.100
Rpim	0.063	0.659
Number of reflections	799423	50904
<I/σ(I)>	21.1
Completeness [%]	93.9
Redundancy	15.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.2 M Potassium acetate, 20% (w/v) PEG 3350