6HM8

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

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	2018-04-06
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.9184
Spacegroup name	C 1 2 1
Unit cell lengths	96.361, 55.659, 64.372
Unit cell angles	90.00, 111.89, 90.00

Refinement procedure

Resolution	41.220 - 2.277
R-factor	0.2186
Rwork	0.218
R-free	0.23320
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5lz1
RMSD bond length	0.006
RMSD bond angle	0.954
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]	41.220	2.359
High resolution limit [Å]	2.277	2.277
Rmerge	0.051	0.487
Rmeas	0.059
Number of reflections	14316	1310
<I/σ(I)>	13.99	2.24
Completeness [%]	97.8	90.41
Redundancy	3.8	3.6
CC(1/2)	0.998	0.881

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	10% w/v PEG 8000, 6% v/v 1,5-pentanediol, 14% v/v PEG 200, 10 mM spermine, 10 mM spermidine, 10 mM DL-ornithine, 10 mM 1,4-diaminobutane, 200 mM NaCl, 100 mM GlyGly/AMPD pH 8.5