8QG1

Crystal structure of oxidized respiratory Complex I subunits NuoEF from Aquifex aeolicus bound to ADP-ribose

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	2018-05-05
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.000
Spacegroup name	P 21 21 21
Unit cell lengths	63.129, 116.146, 189.485
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.561 - 2.000
Rwork	0.177
R-free	0.20710
Structure solution method	FOURIER SYNTHESIS
RMSD bond length	0.004
RMSD bond angle	1.029
Data reduction software	autoPROC
Data scaling software	Aimless (0.7.9)
Refinement software	REFMAC (5.8.0352)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.561	2.030
High resolution limit [Å]	2.000	2.000
Rpim	0.039	0.567
Number of reflections	94748	4651
<I/σ(I)>	12.8	1.6
Completeness [%]	99.8	99.9
Redundancy	13.6	14.2
CC(1/2)	0.999	0.777

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		281	trisodium citrate, ammonium sulfate, sodium chloride, Tris, BisTris