8CL6

Lysozyme in matrix of hydroxyethylcellulose (HEC)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	FREE ELECTRON LASER
Source details	SwissFEL ARAMIS BEAMLINE ESA
Synchrotron site	SwissFEL ARAMIS
Beamline	ESA
Temperature [K]	295
Detector technology	PIXEL
Collection date	2020-02-28
Detector	PSI JUNGFRAU 16M
Wavelength(s)	1.03
Spacegroup name	P 43 21 2
Unit cell lengths	77.900, 77.900, 37.690
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	13.540 - 1.320
R-factor	0.1236
Rwork	0.121
R-free	0.15580
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.014
RMSD bond angle	1.503
Data reduction software	CrystFEL (0.9.1)
Data scaling software	CrystFEL (0.9.1)
Phasing software	PHASER (1.20_4459)
Refinement software	PHENIX (1.20_4459)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	14.968	1.370
High resolution limit [Å]	1.320	1.320
Number of reflections	25665	1436
<I/σ(I)>	7.29
Completeness [%]	100.0
Redundancy	739.53
CC(1/2)	0.996	0.196

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	BATCH MODE	3	295	25 mg/mL, 100 mM sodium acetate, lysozyme solution added to 28% (w/v) sodium chloride, 8% (w/v) PEG 6000