8X3Q

tll1591 with alpha-glucan 4sugar

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL18U1
Synchrotron site	SSRF
Beamline	BL18U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-04-15
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97853
Spacegroup name	P 65
Unit cell lengths	155.911, 155.911, 187.487
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	19.980 - 2.660
R-factor	0.2636
Rwork	0.263
R-free	0.29410
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	0.860
Refinement software	PHENIX ((1.18.2_3874: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	19.980	2.720
High resolution limit [Å]	2.660	2.660
Rmerge	0.102	1.008
Number of reflections	73206	4581
<I/σ(I)>	15.6
Completeness [%]	98.9
Redundancy	6.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	PEG