7KLG

SARS-CoV-2 RBD in complex with Fab 15033

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08B1-1
Synchrotron site	CLSI
Beamline	08B1-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-09-13
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.5215
Spacegroup name	P 63 2 2
Unit cell lengths	197.100, 197.100, 211.510
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	47.990 - 3.200
R-factor	0.2719
Rwork	0.271
R-free	0.29020
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6w41
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.16rc1_3535)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	47.990	47.990	3.160
High resolution limit [Å]	3.050	5.000	3.050
Rmerge	0.291	0.098	4.524
Rmeas	0.303	0.102	4.707
Total number of observations	602214
Number of reflections	46622	10998	4618
<I/σ(I)>	7.1	15.92	0.6
Completeness [%]	99.9	99.7	100
Redundancy	12.917	12.586	12.672
CC(1/2)	0.997	0.998	0.294

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	295	1.4 M (NH4)2SO4, 10% 1,2-propanediol