7O26

Complex-B bound [FeFe]-hydrogenase maturase HydE fromT. Maritima (5'dA + Methionine)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID30B
Synchrotron site	ESRF
Beamline	ID30B
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-10-04
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9762
Spacegroup name	P 21 21 21
Unit cell lengths	50.880, 79.840, 86.170
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	43.810 - 1.500
R-factor	0.1798
Rwork	0.178
R-free	0.21650
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]	43.810	1.590
High resolution limit [Å]	1.500	1.500
Number of reflections	107892	8952
<I/σ(I)>	5.28
Completeness [%]	99.5
Redundancy	6.9
CC(1/2)	0.988	0.453

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	PEG; LiSO4; Tris pH 7.4