9Q5U

Crystal structure of Aeromonas salmonicida putative carbohydrate binding module and split domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2025-04-18
Detector	RIGAKU RAXIS IV++
Wavelength(s)	2.2909
Spacegroup name	P 1 21 1
Unit cell lengths	31.279, 81.231, 56.133
Unit cell angles	90.00, 99.03, 90.00

Refinement procedure

Resolution	45.790 - 2.500
R-factor	0.2248
Rwork	0.220
R-free	0.31560
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	1.082
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.21_5207)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	45.791	2.600
High resolution limit [Å]	2.500	2.500
Rmerge	0.113	0.435
Rmeas	0.134	0.521
Rpim	0.072	0.284
Number of reflections	9640	1086
<I/σ(I)>	13.9	4.3
Completeness [%]	99.7	98.3
Redundancy	6.2	6.1
CC(1/2)	0.993	0.912

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	6	293	20% w/v PEG 6000, 0.2M Calcium chloride, 5% w/v n-Octyl-B-D-glucoside, 0.1M MES