9QM0

W-formate dehydrogenase U192C from Desulfovibrio vulgaris

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE MASSIF-3
Synchrotron site	ESRF
Beamline	MASSIF-3
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-06-18
Detector	DECTRIS EIGER R 4M
Wavelength(s)	0.9677
Spacegroup name	P 21 21 21
Unit cell lengths	62.396, 123.099, 147.189
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	63.167 - 1.833
Rwork	0.172
R-free	0.21350
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	1.262
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]	63.167	2.006
High resolution limit [Å]	1.833	1.833
Number of reflections	74505	3725
<I/σ(I)>	5.959
Completeness [%]	92.9
Redundancy	4.83
CC(1/2)	0.988	0.668

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8	293	34% PEG 3350, 0.1M Tris-HCl pH 8.0, 1M LiCl