6F2K

Crystal structure of Hen Egg-White Lysozyme co-crystallized in presence of 100 mM Tb-Xo4 and 100 mM potassium phosphate monobasic.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE BM30A
Synchrotron site	ESRF
Beamline	BM30A
Temperature [K]	100
Detector technology	CCD
Collection date	2017-01-28
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9797
Spacegroup name	P 43 21 2
Unit cell lengths	78.359, 78.359, 37.404
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	35.040 - 1.500
R-factor	0.2
Rwork	0.198
R-free	0.24000
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1h87
RMSD bond length	0.010
RMSD bond angle	1.020
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	BUSTER (2.10.3)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.180	1.580
High resolution limit [Å]	1.500	1.500
Rmerge	0.084	1.120
Rpim	0.025	0.320
Number of reflections	19187	2702
<I/σ(I)>	19.16	2.4
Completeness [%]	98.2	98.6
Redundancy	13.7	13.9
CC(1/2)		0.819

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	100 mM sodium acetate pH 4.6, 200 to 800 sodium chloride, 100 mM Potassium phosphate monobasic. Tb-Xo4 was directly mixed with the protein solution at a final concentration of 100 mM prior to crystallization.