7O1O

Complex-B bound [FeFe]-hydrogenase maturase HydE fromT. Maritima (Auxiliary cluster deleted variant)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 1
Synchrotron site	SOLEIL
Beamline	PROXIMA 1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-07-04
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	0.9786
Spacegroup name	P 21 21 2
Unit cell lengths	63.420, 81.760, 70.420
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	35.350 - 1.250
R-factor	0.1296
Rwork	0.128
R-free	0.15230
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3ciw
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.000	1.320
High resolution limit [Å]	1.250	1.250
Number of reflections	102038	15906
<I/σ(I)>	11.6
Completeness [%]	99.4
Redundancy	14.7
CC(1/2)	0.997	0.703

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	PEG; LiSO4; Tris pH 7.5