7LC5

Crystal structure of epoxyqueuosine reductase QueH from Thermotoga maritima

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-D
Synchrotron site	APS
Beamline	23-ID-D
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-08-07
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.033
Spacegroup name	C 2 2 21
Unit cell lengths	53.224, 105.181, 73.899
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.490 - 1.500
R-factor	0.1963
Rwork	0.196
R-free	0.21130
Structure solution method	SAD
RMSD bond length	0.006
RMSD bond angle	0.805
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	AutoSol
Refinement software	PHENIX (1.16_3549)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.490	1.551
High resolution limit [Å]	1.497	1.497
Rmerge	0.044	0.708
Rmeas	0.046	0.739
Rpim	0.013	0.207
Number of reflections	33575	3276
<I/σ(I)>	36.83	4.85
Completeness [%]	99.3
Redundancy	13
CC(1/2)	1.000	0.929

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.5	293	100 mM Bis-Tris, pH 5.5, 200 mM lithium sulfate monohydrate, 25% PEG3350