9JR7

Crystal structure of PCoV-GX receptor-binding domain complexed with squirrel ACE2

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-12-19
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.98
Spacegroup name	I 41 2 2
Unit cell lengths	196.281, 196.281, 144.629
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.811 - 3.429
R-factor	0.2068
Rwork	0.204
R-free	0.25580
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6m0j
RMSD bond length	0.012
RMSD bond angle	1.271
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	3.552
High resolution limit [Å]	3.429	3.429
Number of reflections	19172	1847
<I/σ(I)>	9.33
Completeness [%]	99.6
Redundancy	24.2
CC(1/2)	0.987	0.847

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291.15	0.2M Sodium bromide, 20% w/v Polyethylene glycol 3350