5M2X

Crystal structure of the full-length Zika virus NS5 protein (Human isolate Z1106033)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-2
Synchrotron site	ESRF
Beamline	ID23-2
Temperature [K]	100
Detector technology	CCD
Collection date	2016-07-16
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	0.8729
Spacegroup name	P 21 21 21
Unit cell lengths	191.060, 192.060, 407.230
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.517 - 4.991
R-factor	0.2295
Rwork	0.227
R-free	0.27580
RMSD bond length	0.002
RMSD bond angle	0.589
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	Arcimboldo
Refinement software	PHENIX ((1.11_2567: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.520	5.110
High resolution limit [Å]	4.990	4.990
Rmerge	0.750	1.694
Number of reflections	65689
<I/σ(I)>	8	3.6
Completeness [%]	99.6	97.3
Redundancy	5	51.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		290	100 mM Sodium Acetate, 0.950 M di-potassium hydrogen phosphate, 1.1 M sodium dihydrogen phosphate