7DT1

The structure of Lactobacillus fermentum 4,6-alpha-Glucanotransferase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2020-10-21
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.9793
Spacegroup name	P 1 21 1
Unit cell lengths	99.830, 106.080, 106.020
Unit cell angles	90.00, 104.83, 90.00

Refinement procedure

Resolution	48.726 - 2.430
R-factor	0.196616983888
Rwork	0.194
R-free	0.25648
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5jbe
RMSD bond length	0.007
RMSD bond angle	0.866
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX (1.11.1_2575)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.730	2.480
High resolution limit [Å]	2.430	2.430
Number of reflections	80425	4541
<I/σ(I)>	7.4
Completeness [%]	99.9
Redundancy	6.9
CC(1/2)	0.993	0.827

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.1 M imidazole/hydrochloric acid buffer pH 8.5, 0.2 M calcium acetate , 10% (w/v) PEG 8000