6LD4

Zika NS5 polymerase domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 2
Synchrotron site	SOLEIL
Beamline	PROXIMA 2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-09-23
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.9538
Spacegroup name	P 1 21 1
Unit cell lengths	64.100, 85.170, 69.810
Unit cell angles	90.00, 113.34, 90.00

Refinement procedure

Resolution	21.910 - 1.500
Rwork	0.196
R-free	0.22380
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5tfr
RMSD bond length	0.013
RMSD bond angle	1.451
Data reduction software	XDS
Data scaling software	XDS
Phasing software	MOLREP
Refinement software	BUSTER

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	21.910	1.550
High resolution limit [Å]	1.500	1.500
Rmerge	0.042	1.250
Number of reflections	109191	10777
<I/σ(I)>	11.84
Completeness [%]	99.2
Redundancy	3.2
CC(1/2)	0.999	0.381

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		293	10% PEG 6000, 0.2M HEPES pH7.5