9RSZ

Crystal structure of Amborella trichopoda ACCO2 in complex with Fe and ACC

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-07-07
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	0.97628
Spacegroup name	P 21 21 21
Unit cell lengths	43.562, 58.618, 113.181
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	52.050 - 1.600
R-factor	0.1754
Rwork	0.174
R-free	0.20030
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	0.888
Data reduction software	xia2
Data scaling software	DIALS
Phasing software	PHASER
Refinement software	PHENIX (1.21.2_5419)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	52.060	1.630
High resolution limit [Å]	1.600	1.600
Rmerge	0.143	2.171
Rmeas	0.149	2.263
Rpim	0.040	0.629
Number of reflections	39112	1946
<I/σ(I)>	9.7
Completeness [%]	100.0
Redundancy	13.3
CC(1/2)	0.999	0.564

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	EVAPORATION	9.5	295.15	0.1 M CHES pH9.5, 25% PEG 3350, microseeding.