9NHV

Fab1534 in complex with the C-terminal alpha-TSR domain of the P. falciparum circumsporozoite protein

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL12-1
Synchrotron site	SSRL
Beamline	BL12-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2025-02-18
Detector	DECTRIS EIGER2 XE 16M
Wavelength(s)	0.97946
Spacegroup name	P 21 21 21
Unit cell lengths	74.408, 84.972, 178.841
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.490 - 2.090
R-factor	0.2103
Rwork	0.208
R-free	0.25260
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.580
Data reduction software	DENZO
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.21.2_5419: ???))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.140
High resolution limit [Å]	2.090	5.700	2.100
Rmerge	0.202	0.070	1.433
Rmeas	0.222	0.077	1.580
Rpim	0.090	0.030	0.649
Number of reflections	65858	3651	2964
<I/σ(I)>	7.6
Completeness [%]	96.6	99.2	88.1
Redundancy	5.7	6	5.2
CC(1/2)	0.993	0.996	0.431

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277	0.18 M tri-ammonium citrate, 20% w/v PEG 3350