9QN3

Fe(II)-2-oxoglutarate-dependent pseudomonal iron uptake factor C in complex with 10 mM 2-oxoglutarate (Mn)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-02-12
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.92271
Spacegroup name	P 1
Unit cell lengths	80.633, 80.685, 88.803
Unit cell angles	62.99, 62.99, 59.98

Refinement procedure

Resolution	75.610 - 1.900
R-factor	0.1728
Rwork	0.173
R-free	0.18480
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	0.891
Data reduction software	DIALS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	75.610	1.930
High resolution limit [Å]	1.900	1.900
Rmerge	0.069	0.465
Rmeas	0.081	0.552
Rpim	0.042	0.294
Number of reflections	127689	6237
<I/σ(I)>	10.2	1.1
Completeness [%]	96.8
Redundancy	3.6
CC(1/2)	0.991	0.747

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6	290	0.1M succinic acid, sodium phosphate monobasic monohydrate, glycine (pH 6) 30% PEG 1000