Table 1 X-ray crystallographic data collection and refinement statistics.

PDB code

7LKE

7LKD

7LBN

 Wavelength

0.9687

0.9687

1.130

 Space group

C2

P21

C2

 a, b, c (Å)

111.303, 53.227, 44.381

44.307, 53.703, 113.933

97.481, 80.729, 51.579

 α, β, γ (°)

90, 101.756, 90

90, 101.012, 90

90, 90, 90

 Resolution (Å)

50.00–2.70

(2.80–2.70)^a

50.00–2.00

(2.03–2.00)^a

50.00–1.76

(1.79–1.76)^a

 R_merge (%)

10.4 (69.5)^a

8.9 (94.6)^a

3.8 (29.5)^a

 I / σI

11.6 (1.4)^a

21.5 (1.6)^a

38.4 (3.9)^a

 Completeness (%)

92.8 (76.3)^a

99.8 (99.9)

97.0 (72.4)^a

 Redundancy

2.9 (2.5)^a

4.3 (3.9)^a

3.2 (2.4)^a

 CC1/2

0.982 (0.531)^a

0.993 (0.474)^a

0.995 (0.905)^a

 Resolution (Å)

50.00–2.70

(2.79–2.70)^b

50.00–2.00

(2.08–2.00)^b

50.00–1.76

(1.83–1.76)^b

 No. of reflections

6591 (472)^b

35,074 (3316)^b

35,055 (3162)^b

 R_work/R_free (%)

22.5/29.3

18.2/22.6

16.6/19.8

 Protein

2323

4716

2332

 Ligand

–

–

63

 Water

0

234

310

 Protein residues

300

610

301

 B factors (Ų)

76.65

37.02

32.13

 Bond lengths (Å)

0.010

0.007

0.008

 Bond angles (°)

1.48

1.01

0.99

 Favored (%)

96.98

97.19

97.32

 Allowed (%)

2.35

2.48

2.68

 Outliers (%)

0.67

0.33

0.0

 Clashscore

10.01

6.97

5.17

 No TLS groups

3

6

3