8SKK

Crystal Structure of the Tick Evasin EVA-AAM1001(L39P) Complexed to Human Chemokine CCL17

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron site	Australian Synchrotron
Beamline	MX2
Temperature [K]	95
Detector technology	PIXEL
Collection date	2023-02-07
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.98
Spacegroup name	P 61
Unit cell lengths	85.468, 85.468, 36.317
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	42.730 - 2.100
R-factor	0.1833
Rwork	0.182
R-free	0.21060
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.835
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	42.730	2.160
High resolution limit [Å]	2.100	2.100
Number of reflections	15184	751
<I/σ(I)>	41.5
Completeness [%]	87.9
Redundancy	19.4
CC(1/2)	0.999	0.998

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	291	2M Ammonium sulfate, 0.1 M HEPES pH 7.0