7VBQ

Heterodimer structure of Fe(II)/(alpha)ketoglutarate-dependent dioxygenase TlxIJ

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE BL-1A
Synchrotron site	Photon Factory
Beamline	BL-1A
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-06-28
Detector	DECTRIS EIGER X 4M
Wavelength(s)	1.1
Spacegroup name	P 21 21 21
Unit cell lengths	58.933, 75.335, 133.611
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.420 - 1.950
R-factor	0.1726
Rwork	0.171
R-free	0.21370
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5zm2
RMSD bond length	0.008
RMSD bond angle	0.955
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.420	2.000
High resolution limit [Å]	1.950	1.950
Rmerge	0.201	1.456
Number of reflections	43789	3021
<I/σ(I)>	13.1	2.3
Completeness [%]	99.2
Redundancy	15.3
CC(1/2)	0.998	0.831

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		283	0.1M Tris-HCl (PH 7.2), 20% (w/v) PEG 3350, 200mM Calcium acetate