8FDD

Crystal structure of Ky15.3 Fab in complex with circumsporozoite protein NPDP peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-1
Synchrotron site	NSLS-II
Beamline	17-ID-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-09-01
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.920088
Spacegroup name	P 1 21 1
Unit cell lengths	38.452, 83.301, 66.364
Unit cell angles	90.00, 99.70, 90.00

Refinement procedure

Resolution	37.900 - 1.540
R-factor	0.1762
Rwork	0.175
R-free	0.20350
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	0.953
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.000	1.560
High resolution limit [Å]	1.540	1.540
Number of reflections	60897	2259
<I/σ(I)>	12.2
Completeness [%]	100.0
Redundancy	7
CC(1/2)	0.998	0.656

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293.15	0.1 M CHES pH 9.5, 30% PEG3000