7KLH

SARS-CoV-2 RBD in complex with Fab 15033-7

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	197.270, 197.270, 211.090
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	49.318 - 3.000
R-factor	0.2574
Rwork	0.256
R-free	0.28350
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]	49.318	49.318	2.990
High resolution limit [Å]	2.880	5.000	2.880
Rmerge	0.178	0.058	4.622
Rmeas	0.185	0.060	4.811
Total number of observations	721045
Number of reflections	55200	10995	5778
<I/σ(I)>	11.18	28.55	0.55
Completeness [%]	99.9	99.7	100
Redundancy	13.062	12.641	13.287
CC(1/2)	0.999	0.999	0.180

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	295	1.4 M (NH4)2SO4 16% glycerol