7W6R

Structure of Bat coronavirus RaTG13 spike receptor-binding domain complexed with its receptor equine ACE2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-12-02
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97852
Spacegroup name	P 1 21 1
Unit cell lengths	64.782, 122.837, 68.797
Unit cell angles	90.00, 92.42, 90.00

Refinement procedure

Resolution	46.160 - 2.600
R-factor	0.1924
Rwork	0.192
R-free	0.19350
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6lzg
RMSD bond length	0.004
RMSD bond angle	0.695
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.690
High resolution limit [Å]	2.600	2.600
Rmerge	0.171	1.032
Rmeas	0.187
Rpim	0.075	0.448
Number of reflections	32977	3285
<I/σ(I)>	10.5	1.8
Completeness [%]	99.9	100
Redundancy	6.3	6.4
CC(1/2)	0.964	0.793

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291	0.2M Lithium chloride, 0.1M Tris 8.0, 20% (w/v) PEG 6000