9JOS

STRUCTURE OF ENDO-1,3-FUCANASE FROM GH168 FAMILY

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-06-23
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97923
Spacegroup name	H 3
Unit cell lengths	148.280, 148.280, 42.040
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	74.140 - 1.700
R-factor	0.1682
Rwork	0.166
R-free	0.20470
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.010
RMSD bond angle	1.069
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	74.140	1.740
High resolution limit [Å]	1.700	1.700
Rmerge	0.079	1.075
Rmeas	0.084	1.193
Rpim	0.027	0.505
Total number of observations	343059
Number of reflections	37521	2549
<I/σ(I)>	20.4
Completeness [%]	99.0
Redundancy	9.1	5.3
CC(1/2)	1.000	0.624

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		290	0.2 M Lithium sulfate monohydrate, 0.1 M Tris pH 8.5, 25% w/v Polyethylene glycol 3,350