8F2G

Crystal structure of Hen Egg White Lysozyme at 0.44 GPa

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX1
Synchrotron site	Australian Synchrotron
Beamline	MX1
Temperature [K]	298
Detector technology	PIXEL
Collection date	2022-08-12
Detector	DECTRIS EIGER2 X 9M
Wavelength(s)	0.71092
Spacegroup name	P 43 21 2
Unit cell lengths	79.045, 79.045, 37.865
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	35.350 - 1.840
R-factor	0.2187
Rwork	0.217
R-free	0.26340
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2yvb
Data reduction software	XDS
Data scaling software	Aimless (0.7.8)
Refinement software	PHENIX (1.19.1-4122)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	39.520	39.520	1.880
High resolution limit [Å]	1.840	9.020	1.840
Rmerge	0.111	0.033	1.377
Rmeas	0.124	0.037	1.557
Rpim	0.055	0.016	0.708
Total number of observations	31390	472	1609
Number of reflections	6894	90	383
<I/σ(I)>	7	27.1	0.7
Completeness [%]	63.2	72.8	57.3
Redundancy	4.6	5.2	4.2
CC(1/2)	0.994	0.997	0.440

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	4.7	293	1 M NaCl, 100 mM Na acetate, pH 4.7