7O2O

Lysozyme structure from microfluidic-based in situ data collection

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 1
Synchrotron site	SOLEIL
Beamline	PROXIMA 1
Temperature [K]	298.15
Detector technology	PIXEL
Collection date	2020-07-21
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97856
Spacegroup name	P 43 21 2
Unit cell lengths	79.599, 79.599, 37.867
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	56.280 - 1.833
R-factor	0.1772
Rwork	0.176
R-free	0.19600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1lyz
RMSD bond length	0.008
RMSD bond angle	0.920
Data reduction software	XDS
Data scaling software	XDS
Phasing software	MOLREP (11.7.2)
Refinement software	BUSTER (2.10.4)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	56.280	1.860
High resolution limit [Å]	1.833	1.833
Rmerge	0.111	0.578
Rmeas	0.113	0.614
Rpim	0.021	0.200
Number of reflections	11146	525
<I/σ(I)>	22.2	2.8
Completeness [%]	100.0	99.4
Redundancy	27.5	8.5
CC(1/2)	0.990	0.884

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROFLUIDIC		283.15	50 mM NaOAc/HOAc, pH 3.5 1 M NaCl 35% EG, 12.5% PEG-3350