9CMX

Human DJ-1, fixed target serial crystallography

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CHESS BEAMLINE 7B2
Synchrotron site	CHESS
Beamline	7B2
Temperature [K]	293
Detector technology	PIXEL
Collection date	2024-02-11
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	0.969
Spacegroup name	P 31 2 1
Unit cell lengths	76.327, 76.327, 76.452
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	50.000 - 1.630
R-factor	0.1459
Rwork	0.144
R-free	0.16810
Structure solution method	FOURIER SYNTHESIS
RMSD bond length	0.011
RMSD bond angle	1.140
Data reduction software	DIALS
Data scaling software	DIALS
Phasing software	PHENIX (1.19.2_4158)
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	66.100	1.660
High resolution limit [Å]	1.630	1.630
Rmerge	0.224	4.819
Number of reflections	32118	1632
<I/σ(I)>	8.5	0.7
Completeness [%]	98.6	99.69
Redundancy	11.4	11.5
CC(1/2)	0.990	0.260

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	BATCH MODE	7.5	293	100 mM HEPES, 200 mM NaCl, 15% (w/v) PEG 3350