7PI3

PfCyRPA bound to Fab fragments from monoclonal antibodies Cy.003, Cy.004 and Cy.007

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-08-07
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.9795
Spacegroup name	P 43
Unit cell lengths	164.842, 164.842, 382.311
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.640 - 3.269
R-factor	0.2852
Rwork	0.285
R-free	0.29760
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5tih
RMSD bond length	0.007
RMSD bond angle	0.900
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	BUSTER (2.10.4 (20-OCT-2021))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	164.840	3.280
High resolution limit [Å]	3.269	3.270
Number of reflections	1115594	1589
<I/σ(I)>	9.4
Completeness [%]	99.9
Redundancy	7.1
CC(1/2)	0.998	0.586

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	0.25 % 1,5-Naphthalenedisulfonic acid disodium salt, 0.25 % 2,7-naphthalenedisulfonic acid disodium salt, 0.25 % 5-Sulfoisophthalic acid monosodium salt, 0.25 % sulfanilic acid, 0.02 M HEPES sodium pH 6