7E0V

GDPD from Pyrococcus furiosus DSM 3638

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-11-29
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97921
Spacegroup name	P 1 21 1
Unit cell lengths	70.330, 45.870, 96.660
Unit cell angles	90.00, 109.14, 90.00

Refinement procedure

Resolution	66.440 - 1.650
R-factor	0.1583
Rwork	0.157
R-free	0.19210
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4oec
RMSD bond length	0.017
RMSD bond angle	1.430
Data reduction software	Aimless
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.19.1_4122)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	66.440	1.690
High resolution limit [Å]	1.650	1.650
Number of reflections	68423	4817
<I/σ(I)>	13.1
Completeness [%]	97.4
Redundancy	6.4
CC(1/2)	0.997	0.654

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		289	0.1M Hepes (pH 7.5), 25% w/v PEG3350, 0.2M Ammonium sulfate