Table 1. Crystallization of cgHle and X-ray diffraction of cgHle crystals.

Values in parentheses are for the highest resolution shell.

Crystal No.	1	2	3	4
Reservoir composition	24%(w/v) PEG 8000, 0.2 M magnesium acetate, 0.1 M sodium cacodylate pH 6.6	24%(w/v) PEG 8000, 0.2 M magnesium acetate, 0.1 M sodium cacodylate pH 6.6	24%(w/v) PEG 4000, 20%(v/v) glycerol, 0.16 M MgCl2, 80 mM Tris–HCl pH 8.5	25.5%(w/v) PEG 4000, 15%(v/v) glycerol, 0.17 M lithium sulfate, 85 mM Tris–HCl pH 8.5
Drop composition before equilibration	0.8 µl cgHle solution, 0.4 µl reservoir solution, 0.4 µl 20 mM acetyl-CoA, 0.48 µl 30%(v/v) ethylene glycol	0.8 µl cgHle solution,0.4 µl reservoir solution, 0.1 µl 30%(v/v) ethylene glycol	0.8 µl cgHle solution, 0.4 µl reservoir solution	0.8 µl cgHle solution, 0.4 µl reservoir solution
Cryoprotectant solution	24%(w/v) PEG 8000, 0.2 M magnesium acetate, 0.1 M sodium cacodylate, 20%(v/v) ethylene glycol pH 6.6	24%(w/v) PEG 8000, 0.2 M magnesium acetate, 0.1 M sodium cacodylate, 20%(v/v) ethylene glycol pH 6.6	—	—
Beamline	X12, EMBL, Hamburg	X12, EMBL, Hamburg	14.1, BESSY, Berlin	14.1, BESSY, Berlin
Wavelength (Å)	0.90000	0.90000	0.91841	0.91841
Space group	P21	P212121	P212121	P3121 or P3221
Unit-cell parameters (Å, °)	a = 56.79, b = 71.79, c = 91.14, β = 92.82	a = 72.47, b = 98.96, c = 105.41	a = 44.15, b = 89.58, c = 322.62	a = 143.57, b = 143.5, c = 197.86
VM (Å3 Da−1)	2.39	2.43	2.05	7.52
Solvent content (%)	48.6	49.5	40.1	83.7
Resolution range (Å)	20.0–2.0 (2.07–2.00)	51.2–1.2 (1.24–1.20)	45.0–1.9 (1.97–1.90)	48.5–3.3 (3.42–3.30)
Rmerge (%)	17.0 (44.6)	11.5 (62.8)	17.7 (76.7)	12.9 (79.2)
Completeness (%)	97.2 (93.9)	98.3 (96.9)	92.6 (93.0)	100 (100)
Redundancy	3.1 (2.9)	6.9 (5.2)	9.4 (9.5)	9.4 (8.7)
Signal-to-noise ratio [I/σ(I)]	6.3 (2.2)	16.0 (2.3)	11.8 (2.3)	18.8 (2.4)
Wilson B factor (Å2)	10.4	7.8	16.8	100.1