7N7I

X-ray crystal structure of Viperin-like enzyme from Trichoderma virens

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-2
Synchrotron site	NSLS-II
Beamline	17-ID-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-12-07
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9893
Spacegroup name	P 31
Unit cell lengths	85.943, 85.943, 111.718
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	28.140 - 3.190
R-factor	0.228
Rwork	0.226
R-free	0.26010
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5vsl
Data reduction software	XDS
Data scaling software	Aimless (0.7.4)
Phasing software	PHASER
Refinement software	PHENIX (1.17.1_3660)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	28.140	28.140	3.410
High resolution limit [Å]	3.190	9.020	3.190
Rmerge	0.200	0.095	1.400
Rmeas	0.409	0.100	1.180
Rpim	0.129	0.030	0.473
Number of reflections	15361	676	2598
<I/σ(I)>	8.46
Completeness [%]	98.8	97.4	93.9
Redundancy	10.3	10.9	9.7
CC(1/2)	0.982	0.997	0.616

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	298	0.1 M Tris-HCl, pH 8.5, 0.2 M sodium chloride, 25% (w/v) PEG 3350