7NJJ

Proteinase K grown inside HARE serial crystallography chip

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, EMBL c/o DESY BEAMLINE P14 (MX2)
Synchrotron site	PETRA III, EMBL c/o DESY
Beamline	P14 (MX2)
Temperature [K]	293
Detector technology	PIXEL
Collection date	2020-06-13
Detector	DECTRIS EIGER X 4M
Wavelength(s)	0.9762
Spacegroup name	P 43 21 2
Unit cell lengths	68.500, 68.500, 108.650
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	57.950 - 1.650
R-factor	0.1792
Rwork	0.178
R-free	0.20330
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6j43
RMSD bond length	0.006
RMSD bond angle	0.764
Data reduction software	CrystFEL
Data scaling software	CrystFEL
Phasing software	PHASER
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	68.490	1.709
High resolution limit [Å]	1.650	1.650
Number of reflections	31851	3100
<I/σ(I)>	3.9
Completeness [%]	100.0
Redundancy	72
CC(1/2)	0.899	0.411

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		293	1 M NaNO3, 0.1 M sodium citrate pH 6.5