6Q9J

Crystal structure of reduced Aquifex aeolicus NADH-quinone oxidoreductase subunits NuoE G129S and NuoF bound to NADH

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-11-24
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.000
Spacegroup name	P 21 21 21
Unit cell lengths	63.637, 116.339, 190.286
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.150 - 1.830
R-factor	0.1731
Rwork	0.172
R-free	0.19670
RMSD bond length	0.004
RMSD bond angle	1.219
Data scaling software	Aimless (0.7.3)
Refinement software	REFMAC (5.8.0238)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	48.150	48.150	1.860
High resolution limit [Å]	1.830	10.020	1.830
Rmerge	0.153	0.048	1.771
Rmeas	0.159	0.050	1.837
Rpim	0.043	0.014	0.486
Number of reflections	124614	884	6107
<I/σ(I)>	11.8
Completeness [%]	99.6	98.8	99.5
Redundancy	13.7	12	14.1
CC(1/2)	0.999	0.999	0.761

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	EVAPORATION	6.75	281	(NH4)2SO4, BisTris, NaCl, cryo-protection with glycerol