8XO6

Crystal structure of measles virus fusion inhibitor MEK35GE complexed with F protein HR1 (HR1-42) (P21212 space group)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL45XU
Synchrotron site	SPring-8
Beamline	BL45XU
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-12-02
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.000000
Spacegroup name	P 21 21 2
Unit cell lengths	56.049, 59.768, 63.674
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	43.604 - 1.457
Rwork	0.176
R-free	0.20810
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.015
RMSD bond angle	1.695
Data reduction software	XDS
Data scaling software	XDS
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.550
High resolution limit [Å]	1.457	1.457
Rmeas	0.098	0.875
Number of reflections	37542	5874
<I/σ(I)>	16.92	2.83
Completeness [%]	98.6	96.6
Redundancy	13.14
CC(1/2)	0.997	0.968

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	293	200 mM Zn Acetate, 18% (w/v) PEG 8000, 100 mM MES (pH 6.5)