8PYQ

10 micrometer HEWL crystals solved at room-temperature using fixed-target serial crystallography.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	FREE ELECTRON LASER
Source details	SwissFEL ARAMIS BEAMLINE ESC
Synchrotron site	SwissFEL ARAMIS
Beamline	ESC
Temperature [K]	293
Detector technology	PIXEL
Collection date	2022-08-20
Detector	PSI JUNGFRAU 8M
Wavelength(s)	1.09
Spacegroup name	P 43 21 2
Unit cell lengths	79.200, 79.200, 38.200
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.600 - 1.400
R-factor	0.147
Rwork	0.144
R-free	0.17860
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.005
RMSD bond angle	0.799
Data reduction software	CrystFEL (0.10.1)
Data scaling software	CrystFEL (0.10.1)
Phasing software	PHASER (1.20.1_4487)
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.600	1.433
High resolution limit [Å]	1.398	1.398
Number of reflections	46389	3266
<I/σ(I)>	4.56	0.55
Completeness [%]	100.0
Redundancy	295
CC(1/2)	0.977	0.274

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	BATCH MODE	3	293	19.6% (w/v) NaCl, 5.6% (w/v) PEG 6000, 0.1 M NaAc pH 3.0