6O01

X-ray structure of H5N1-NS1 R38A K41A G71E mutant

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.2.1
Synchrotron site	ALS
Beamline	8.2.1
Temperature [K]	293.15
Detector technology	CCD
Collection date	2018-01-17
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.999949
Spacegroup name	P 65 2 2
Unit cell lengths	105.570, 105.570, 82.400
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	30.604 - 3.000
R-factor	0.2316
Rwork	0.229
R-free	0.27930
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3f5t
RMSD bond length	0.005
RMSD bond angle	0.844
Data reduction software	MOSFLM
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.604	3.107
High resolution limit [Å]	3.000	3.000
Rmerge	0.099	1.640
Number of reflections	5785	566
<I/σ(I)>	2.1
Completeness [%]	99.7
Redundancy	19.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	293.15	0.1 M Sodium acetate trihydrate and 0.1 M Tris hydrochloride pH 8.5