6FRO

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

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)	0.92356
Spacegroup name	P 43 21 2
Unit cell lengths	78.832, 78.832, 35.360
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.410 - 1.420
R-factor	0.258
Rwork	0.257
R-free	0.27600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1h87
RMSD bond length	0.008
RMSD bond angle	1.090
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]	39.410	1.490
High resolution limit [Å]	1.420	1.420
Rmerge	0.105	1.916
Rpim	0.029	0.520
Number of reflections	21311
<I/σ(I)>	13.8	1.4
Completeness [%]	98.3	97
Redundancy	14	13.7
CC(1/2)		0.750

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	Sodium acetate pH 4.6 100 mM, Sodium Chloride 800 mM, potassium iodide 100 mM. Tb-Xo4 was directly mixed with the protein solution at a final concentration of 100 mM prior to crystallization.