6NRL

X-ray structure of H6N6-NS1 delta(80-84) R38A K41A E71G 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	2018-05-15
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.999949
Spacegroup name	P 65 2 2
Unit cell lengths	105.190, 105.190, 80.210
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	34.432 - 3.200
R-factor	0.2442
Rwork	0.243
R-free	0.25930
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4oph
RMSD bond length	0.004
RMSD bond angle	0.901
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]	34.432	3.315
High resolution limit [Å]	3.200	3.200
Rmerge	0.135	0.163
Number of reflections	4652	661
<I/σ(I)>	2.1
Completeness [%]	99.6	100
Redundancy	19.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	293.15	0.2 M Sodium citrate, 0.1 M Tris hydrochloride pH 8.5, and 30% (v/v) PEG 400