6SYC

Crystal structure of the lysozyme in presence of bromophenol blue at pH 6.5

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALBA BEAMLINE XALOC
Synchrotron site	ALBA
Beamline	XALOC
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-12-05
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	0.97926
Spacegroup name	P 21 21 21
Unit cell lengths	37.719, 76.559, 84.076
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	19.390 - 1.380
R-factor	0.1928
Rwork	0.191
R-free	0.22610
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6f1m
RMSD bond length	0.007
RMSD bond angle	0.896
Data reduction software	XDS
Data scaling software	Aimless (0.6.3)
Phasing software	PHASER
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	19.395	1.410
High resolution limit [Å]	1.380	1.380
Rmerge	0.100	0.397
Rmeas	0.115	0.484
Rpim	0.055	0.271
Total number of observations		7286
Number of reflections	90196	2490
<I/σ(I)>	7.3	1.8
Completeness [%]	97.5	97.2
Redundancy	3.8	2.9
CC(1/2)	0.990	0.797

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	298	0.3 M sodium chloride, 0.1 M imidazole. After growth, and before measurement, these crystals were soaked in the dye solution: saturated bromophenol blue, 0.3 M sodium chloride, 0.1 M imidazole buffer at pH 6.5.