Table 1 Data collection and refinement statistics

From: A family of unconventional deubiquitinases with modular chain specificity determinants

 

ZUFSP S-SAD

ZUFSP native

Data collection

Space group

P6522

P6522

Unit cell constants

a, b, c (Å)

84.2, 84.2, 201.8

84.2, 84.2, 201.8

\(\alpha , \; \beta , \, \gamma\) (°)

90, 90, 120

90, 90, 120

Wavelength (Å)

2.07

0.98

Resolution (Å)

59.13–2.3 (2.38–2.3)

49.45–1.73 (1.79–1.73)

No. of observations

4,098,044 (364,012)

484,411 (48,504)

No. of unique reflections

35,609 (3576)a

44,866 (4337)

Multiplicity

115.1 (101.8)

10.8 (11.2)

Completeness (%)

100 (100)

100 (99)

Rmerge (%)

11.7 (39.5)

8.4 (82.4)

Rmeas (%)

11.8 (39.7)

14.3 (86.4)

<I/\(\sigma\)(I)>

47.7 (13.9)

16.6 (2.5)

CC1/2 (%)

100 (99.7)

99.8 (79.5)

Anomalous signal

  

CCano (59.13–3 Å [3.08–3.0 Å]) (%)

56 (31)

 

Rpim (59.13– 3 Å [3.08–3.0 Å]) (%)

0.8 (1.4)

 

Refinement

Reflections used in refinement

 

44,862

Number of test reflections

 

1930

Rwork/Rfree (%)

 

17.8/20.7

Root-mean-square deviations

Bond lengths (Å)

 

0.005

Bond angles (°)

 

0.6

Average B factor (Å2)

All macromolecule atoms

 

37.0

Solvent molecules

 

39.5

Other atoms

 

24.3

Ramachandran plot (%)

Most favored

 

97.7

Additionally allowed

 

2.2

Disallowed

 

0.0

  1. aFriedel pairs were kept separate