9GQX

influenza neuraminidase mSN1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I24
Synchrotron site	Diamond
Beamline	I24
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-12-12
Detector	DECTRIS EIGER2 X CdTe 9M
Wavelength(s)	0.6199
Spacegroup name	P 4
Unit cell lengths	92.165, 92.165, 147.903
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	92.170 - 1.980
R-factor	0.2114
Rwork	0.211
R-free	0.23820
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.670
Data reduction software	xia2
Data scaling software	xia2
Phasing software	PHASER
Refinement software	PHENIX (1.21.1_5286)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	147.900	2.010
High resolution limit [Å]	1.980	1.980
Number of reflections	85857	4278
<I/σ(I)>	2.8
Completeness [%]	100.0
Redundancy	14.2
CC(1/2)	0.976	0.342

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293.15	0.03 M NaFl, 0.03 M NaBr, 0.03 M NaI, 0.1 M imidazole/MES pH6.5, 30% ethylene glycol/PEG 8K