8BQL

W-formate dehydrogenase from Desulfovibrio vulgaris - Co-crystallized with Formate and Reoxidized by exposure to air for 12 min

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	2022-07-06
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9686
Spacegroup name	P 21 21 21
Unit cell lengths	64.800, 127.594, 148.622
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	96.999 - 1.906
Rwork	0.188
R-free	0.22510
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6sdv
RMSD bond length	0.004
RMSD bond angle	1.278
Data reduction software	autoPROC
Data scaling software	STARANISO
Phasing software	PHASER
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	96.999	2.008
High resolution limit [Å]	1.906	1.906
Number of reflections	82382	4121
<I/σ(I)>	9.086
Completeness [%]	94.5
Redundancy	10.95
CC(1/2)	0.997	0.620

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8	293	26% PEG 3350, 0.1M Tris-HCl pH 8.0, 1M LiCl, 10 mM sodium formate