Table 1 Data Collection and Refinement Statistics.

From: Laminarinase from Flavobacterium sp. reveals the structural basis of thermostability and substrate specificity

 

Se-labeled

Native

Data Collection

Beamline

PF BL-5A

PF BL-5A

Wavelength (Å)

0.97935

1.00000

Space group

P21

P212121

Unit-cell parameters (Å)

a = 66.6, b = 64.5, c = 70.4

a = 64.6, b = 80.9, c = 109.5

(°)

β = 106.5

 

Resolution (Å)a

50.0−2.50 (2.56−2.50)

50.0−1.60 (1.64−1.60)

No. of unique reflections

38794

76300

Completeness (%)a

99.8 (99.7)

99.9 (100.0)

R sym a,b

0.081 (0.128)

0.053 (0.305)

〈I/σ(I)〉a

19.80 (13.24)

25.71 (6.60)

Redundancy

7.4

7.2

Refinement

R work/R free(%)

 

17.6/20.6

No. of atoms

  Protein

 

3753

  Water

 

670

RMSDc

  Bond length (Å)

 

0.008

  Bond angle (°)

 

1.180

Ramachandran plot (%)

  Favored

 

97.4

  Allowed

 

2.6

  Disallowed

 

0

PDB code

 

5WUT

  1. aValues in parentheses are for the highest resolution shell.
  2. b R sym = Σ hkl [(Σ i |I i  − 〈I〉|)/Σ i I i ], where I i is the ith intensity measurement of the reflection hkl, including symmetry-related reflections, and 〈I〉 is its average.
  3. cRMSD, root-mean-square deviation.
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