8F2J

Crystal structure of antibody WRAIR-2134 in complex with SARS-CoV-2 receptor binding domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-E
Synchrotron site	APS
Beamline	24-ID-E
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-06-21
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97
Spacegroup name	P 21 21 21
Unit cell lengths	143.190, 154.430, 165.250
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.960 - 3.160
R-factor	0.2106
Rwork	0.209
R-free	0.24530
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5ggu 6b0w 7n4j
RMSD bond length	0.004
RMSD bond angle	0.799
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.20_4459)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	3.330
High resolution limit [Å]	3.150	3.150
Number of reflections	121509	19496
<I/σ(I)>	7.15	1.05
Completeness [%]	99.7	99.1
Redundancy	3.57
CC(1/2)	0.990	0.428

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		293	8% v/v Tacsimate pH 5.0, 20% w/v Polyethylene glycol 3350