8S7B

Fe(II)-2-oxoglutarate-dependent Oryza sativa dioxygenase His1 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	2024-02-21
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9762
Spacegroup name	C 1 2 1
Unit cell lengths	68.332, 67.432, 83.176
Unit cell angles	90.00, 92.09, 90.00

Refinement procedure

Resolution	47.980 - 1.750
R-factor	0.1762
Rwork	0.175
R-free	0.20260
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	0.607
Data reduction software	autoPROC
Data scaling software	autoPROC
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.980	1.878
High resolution limit [Å]	1.750	1.750
Rmerge	0.060	0.895
Rmeas	0.065	0.979
Rpim	0.024	0.389
Number of reflections	38126	1899
<I/σ(I)>	18.5	1.1
Completeness [%]	99.8	96.1
Redundancy	7	6.1
CC(1/2)	0.999	0.804

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.6	290	0.15 M Magnesium acetate tetrahydrate 0.1 M Sodium citrate 5.6 20 % v/v PEG Smear Broad 15% Glycerol used for collection