9RV6

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

Replaces:  8PYO

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	2022-09-01
Detector	PSI JUNGFRAU 8M
Wavelength(s)	1.09
Spacegroup name	P 43 21 2
Unit cell lengths	79.520, 79.520, 38.460
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	27.760 - 1.550
R-factor	0.186
Rwork	0.183
R-free	0.21400
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.001
RMSD bond angle	0.974
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]	39.500	1.580
High resolution limit [Å]	1.550	1.550
Number of reflections	17973	1358
<I/σ(I)>	6.96	0.97
Completeness [%]	99.8	99.85
Redundancy	326	231
CC(1/2)	0.986	0.312

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	BATCH MODE	3	293	50mg/ml hewl, 22.4% (w/v) NaCl, 6.4% (w/v) PEG 6000, 0.1 M NaAc pH 3.0