9SCF

Fe(II)-2-oxoglutarate-dependent Pseudomonas savastanoi pv phaseolicola 1449B in complex with 2-oxoglutarate

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	2024-09-24
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97628
Spacegroup name	P 43
Unit cell lengths	56.063, 56.063, 100.988
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.640 - 1.650
R-factor	0.1729
Rwork	0.172
R-free	0.19770
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.010
RMSD bond angle	1.062
Data reduction software	DIALS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.21.2_5419)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	56.080	1.680
High resolution limit [Å]	1.650	1.650
Rmerge	0.102	1.587
Rmeas	0.107	0.483
Rpim	0.031	1.660
Number of reflections	37374	1740
<I/σ(I)>	10.7	1.1
Completeness [%]	99.8
Redundancy	11.5
CC(1/2)	0.999	0.867

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		290	0.03 M Citric acid, 0.07 M BIS-TRIS propane (pH 7.6), 20% w/v Polyethylene glycol (PEG) 3350