9RJW

W-formate dehydrogenase from Nitratidesulfovibrio vulgaris (Desulfovibrio vulgaris) - aerobic soaked with 100 bar Kr

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-1
Synchrotron site	ESRF
Beamline	ID23-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-03-01
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.8610
Spacegroup name	P 21 21 21
Unit cell lengths	64.665, 128.313, 148.735
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	97.155 - 1.640
Rwork	0.188
R-free	0.21870
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.010
RMSD bond angle	1.648
Data reduction software	XDS
Data scaling software	STARANISO
Phasing software	PHASER
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	97.155	1.733
High resolution limit [Å]	1.640	1.640
Number of reflections	135242	6762
<I/σ(I)>	14.08
Completeness [%]	96.5
Redundancy	13.31
CC(1/2)	0.999	0.637

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	22% PEG 3350, 0.1M Tris-HCl pH 8.0, 1M LiCl