9ORV

X-ray diffraction structure of lysozyme co-crystallized with N,N',N"-triacetylchitotriose

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-E+
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2025-05-19
Detector	RIGAKU
Wavelength(s)	1.5418
Spacegroup name	P 43 21 2
Unit cell lengths	77.530, 77.530, 37.890
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.770 - 1.600
R-factor	0.1895
Rwork	0.188
R-free	0.21000
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.860
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	38.770	1.700
High resolution limit [Å]	1.600	1.600
Rmerge	0.063
Number of reflections	29129	4827
<I/σ(I)>	17.39	3.67
Completeness [%]	99.9	100
Redundancy	7.2	7
CC(1/2)	0.999	0.879

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	800 mM NaCl, 80 mM sodium acetate pH 4.8