7QZ1

Formate dehydrogenase from Starkeya novella

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, EMBL c/o DESY BEAMLINE P14 (MX2)
Synchrotron site	PETRA III, EMBL c/o DESY
Beamline	P14 (MX2)
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-06-16
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.99
Spacegroup name	P 1
Unit cell lengths	59.255, 59.481, 122.673
Unit cell angles	79.89, 85.41, 63.15

Refinement procedure

Resolution	52.870 - 2.100
R-factor	0.178
Rwork	0.176
R-free	0.22400
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2nac
RMSD bond length	0.007
RMSD bond angle	0.884
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	52.870	2.175
High resolution limit [Å]	2.100	2.100
Number of reflections	79594	7804
<I/σ(I)>	9.89
Completeness [%]	91.5
Redundancy	3.8
CC(1/2)	0.997	0.595

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		295	5-20% PEG 3350, 0.1 M BIS-TRIS pH 5.8-7.2