8WA7

E.coli transketolase soaked with donor ketose D-fructose

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL02U1
Synchrotron site	SSRF
Beamline	BL02U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-05-16
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97901
Spacegroup name	P 21 21 21
Unit cell lengths	90.093, 102.479, 133.872
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.850 - 1.630
R-factor	0.1543
Rwork	0.153
R-free	0.18580
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.011
RMSD bond angle	1.165
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	81.400	1.720
High resolution limit [Å]	1.630	1.630
Number of reflections	151061	22294
<I/σ(I)>	10.5
Completeness [%]	97.7
Redundancy	4.8
CC(1/2)	0.977	0.693

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.9	279	13.5-15% PEG 6000 (w/v), 4% PEG 400 (v/v), 2% glycerol (v/v)