Table 2 Data collection, phasing and refinement statistics for the crystal structure of CjFurZn.

From: Functional insights into the interplay between DNA interaction and metal coordination in ferric uptake regulators

Data collection

CjFurZn

  Space group

P212121

  Cell dimensions

 

    a, b, c (Å)

35.74, 84.36, 123.63

  Resolution

69.68–1.81

  Rsym

6.3 (48.3)!

  I/σI

5.3 (2.9)

  Completeness (%)

100 (100)

  Redundancy

3.4 (2.1)

Refinement

 

  Resolution

34.65–1.81

  Reflections

34641

  Rwork/Rfree

18.6/23.1

  No. atoms

 

    Protein

2369

    Zn2+

2

    Water

398

  B-factors (Å2)

 

    Protein

25.8

    Zn2+

13.7

    Water

37.6

  R.m.s. deviations

 

    Bond lengths (Å)

0.016

    Bond angles (°)

1.33

  Molprobity score

1.59

    Ramachandran favored (%)*

98.9

  1. !Highest resolution shell.
  2. *There are no Ramachandran outliers.
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