8B3T

Hen Egg White Lysozyme 4s in situ crystallization

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PETRA III, DESY BEAMLINE P11
Synchrotron site	PETRA III, DESY
Beamline	P11
Temperature [K]	293
Detector technology	PIXEL
Collection date	2021-09-19
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	1.033
Spacegroup name	P 43 21 2
Unit cell lengths	79.200, 79.200, 37.800
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.600 - 1.780
R-factor	0.1671
Rwork	0.164
R-free	0.20040
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6ftr
RMSD bond length	0.006
RMSD bond angle	0.800
Data reduction software	CrystFEL
Data scaling software	CrystFEL
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.600	1.810
High resolution limit [Å]	1.780	1.780
Number of reflections	12126	601
<I/σ(I)>	10.76
Completeness [%]	100.0	100
Redundancy	408.01	54.7
CC(1/2)	0.992	0.275

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROFLUIDIC		293	0.1 M sodium acetate, pH 4.6, 2.7 M NaCl, 15 % PEG4000, 6 % ethylene glycol