3TI8

Crystal structure of influenza A virus neuraminidase N5 complexed with laninamivir

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE AR-NE3A
Synchrotron site	Photon Factory
Beamline	AR-NE3A
Temperature [K]	100
Detector technology	CCD
Collection date	2010-12-08
Detector	ADSC QUANTUM 270
Wavelength(s)	0.980
Spacegroup name	P 4
Unit cell lengths	112.563, 112.563, 66.809
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.797 - 1.601
R-factor	0.1285
Rwork	0.127
R-free	0.16060
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3sal
RMSD bond length	0.004
RMSD bond angle	1.008
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.5_2))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.660
High resolution limit [Å]	1.600	1.600
Number of reflections	110000
Completeness [%]	100.0	100

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	291	0.1M HEPES (pH 7.5), 12% w/v Polyethylene glycol 3350, VAPOR DIFFUSION, HANGING DROP, temperature 291K