6HMV

Crystal structure of human ACBD3 GOLD domain in complex with 3A protein of enterovirus-D68 (fusion protein, LVVY mutant)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	BESSY BEAMLINE 14.1
Synchrotron site	BESSY
Beamline	14.1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-05-18
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9184
Spacegroup name	P 21 21 21
Unit cell lengths	55.432, 59.165, 85.902
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	40.450 - 2.244
R-factor	0.2323
Rwork	0.231
R-free	0.26520
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5lz1
RMSD bond length	0.004
RMSD bond angle	0.844
Data reduction software	XDS (11-Sep-2018)
Data scaling software	XDS (11-Sep-2018)
Phasing software	PHASER (2.5.6)
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.450	2.324
High resolution limit [Å]	2.244	2.244
Rmerge	0.087	1.082
Rmeas	0.094
Number of reflections	13960	1332
<I/σ(I)>	12.81	1.52
Completeness [%]	99.2	95.42
Redundancy	7.1	6.9
CC(1/2)	0.995	0.750

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	12.5% w/v PEG 1000, 12.5% w/v PEG 3350, 12.5% v/v MPD, 30 mM MgCl2, 30 mM CaCl2, 100 mM bicine/Tris pH 8.5