6PZD

Crystal structure of the neuraminidase stabilization mutant Y169aH from A/Shanghai/2/2013 (H7N9)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL12-2
Synchrotron site	SSRL
Beamline	BL12-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-07-21
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97946
Spacegroup name	I 4 3 2
Unit cell lengths	182.219, 182.219, 182.219
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.949 - 1.120
R-factor	0.113
Rwork	0.112
R-free	0.12800
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5l14
RMSD bond length	0.008
RMSD bond angle	1.171
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.12_2829))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	43.000	1.130
High resolution limit [Å]	1.120	1.120
Rpim	0.020	0.450
Number of reflections	194141	6246
<I/σ(I)>	30.8	1.1
Completeness [%]	99.9
Redundancy	22.3
CC(1/2)	0.999	0.834

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1 M MES pH 6.5, 12% PEG20000