9S7X

Amuc0121_S1_15 in complex with D-Galactose

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04
Synchrotron site	Diamond
Beamline	I04
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-09-09
Detector	DECTRIS EIGER2 S 16M
Wavelength(s)	1.0
Spacegroup name	P 21 21 21
Unit cell lengths	66.510, 91.490, 162.080
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	61.607 - 1.560
Rwork	0.138
R-free	0.18430
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	1.648
Data reduction software	xia2
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0430 (refmacat 0.4.105))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	61.607	1.590
High resolution limit [Å]	1.560	1.560
Number of reflections	141184	6959
<I/σ(I)>	15.8
Completeness [%]	100.0
Redundancy	6.5
CC(1/2)	0.999	0.589

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		298	Morpheus H12- 37.5 % Precipitant mix 4 (25% v/v MPD; 25% PEG 1000; 25% w/v PEG 3350), 0.1 M Buffer system 3 pH 8.5 (Tris (base); BICINE), 0.1 M amino acids (0.2M DL-Glutamic acid monohydrate; 0.2M DL-Alanine; 0.2M Glycine; 0.2M DL-Lysine monohydrochloride; 0.2M DL-Serine) 36 mg/ml Amuc0121 with 100 mM D-Galactose