8FA8

Crystal structure of Ky15.11 Fab in complex with circumsporozoite protein NDN peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-D
Synchrotron site	APS
Beamline	23-ID-D
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-06-19
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.03319
Spacegroup name	P 21 21 21
Unit cell lengths	63.735, 83.149, 92.267
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	28.850 - 1.800
R-factor	0.1785
Rwork	0.177
R-free	0.20140
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.685
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.19_4080)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.000	1.830
High resolution limit [Å]	1.800	1.800
Number of reflections	46199	2205
<I/σ(I)>	15.7
Completeness [%]	99.9
Redundancy	12.9
CC(1/2)	0.998	0.676

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293.15	0.2 M magnesium chloride, 20% PEG8000, 0.1 M Tris pH 8.5