7CHO

Crystal structure of SARS-CoV-2 antibody P5A-1D2 with RBD

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-05-17
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9796
Spacegroup name	C 1 2 1
Unit cell lengths	158.754, 67.509, 154.368
Unit cell angles	90.00, 112.18, 90.00

Refinement procedure

Resolution	36.523 - 2.561
R-factor	0.204
Rwork	0.202
R-free	0.24730
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6m0j
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.15.2_3472)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.660
High resolution limit [Å]	2.560	2.600
Rmerge	0.117	0.799
Number of reflections	47159	3117
<I/σ(I)>	9.5
Completeness [%]	95.9
Redundancy	6.3
CC(1/2)	0.989	0.450

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		298	0.2M Magnesium chloride hexahydrate, 0.1M Tris, pH 8.5, 3.4M 1,6-Hexanediol