7TE1

SARS-CoV-2 Receptor Binding Domain in Complex with Ab17

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-E
Synchrotron site	APS
Beamline	21-ID-E
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-07-26
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9792
Spacegroup name	P 41 21 2
Unit cell lengths	207.931, 207.931, 86.662
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	79.990 - 3.500
R-factor	0.2989
Rwork	0.296
R-free	0.34420
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6m0j 4l5f 4hcl
RMSD bond length	0.003
RMSD bond angle	0.801
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	79.990	3.550
High resolution limit [Å]	3.500	3.500
Rmerge	0.395
Rmeas	0.405
Rpim	0.088
Number of reflections	24539	4607
<I/σ(I)>	10.1
Completeness [%]	100.0	100
Redundancy	21.1
CC(1/2)		0.235

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	291.15	0.1 M HEPES pH 7.0 and 30% v/v Jeffamine ED-2001 pH 7.0