Korean Journal of Microbiology

Indexed in /covered by CAS, KoreaScience & DOI/Crossref:eISSN 2383-9902   pISSN 0440-2413

Table. 1.

Table. 1.

Crystallographic statistics of the bssALDC structure

bssALDC
Data collection
 Space group P21212
 Cell parameters a = 87.28 Å
b = 129.64 Å
c = 45.72 Å
 Wavelength (Å) 1.00004
 Resolution (Å) 30.00-1.70
 Highest resolution (Å) 1.73-1.70
 No. unique reflections 58,087
 Rmerge (%)a 7.0 (38.9)b
 I/sigma (I) 44.1 (7.2)b
 Completeness (%) 99.8 (100.0)b
 Redundancy 7.0 (6.9)b
Refinement
 Resolution (Å) 30.00-1.70
 No. of reflections (work) 54,766
 No. of reflections (test) 2,922
 Rwork (%)c 17.1
 Rfree (%)d 19.1
 No. atoms 3,988
  Protein 3,652
  Ligands (zinc) 2
  Water 334
 Average B-value (Å2) 21.6
 RMSD bonds (Å) 0.017
 RMSD angles (°) 1.58
 Ramachandrane (favored) 97.6%
         (outliers) 0.0%

Rmerge = ΣhklΣi | Ii(hkl) - <I(hkl)> | / ΣhklΣi Ii(hkl)

Numbers in parenthesis were calculated from data of the highest resolution shell.

Rwork = Σ| |Fobs|-|Fcalc| | / Σ|Fobs|, where Fcalc and Fobs are the calculated and observed structure factor amplitudes, respectively.

Rfree = as for Rwork, but for 5% of the total reflections chosen at random and omitted from refinement.

Calculated using MolProbity (http://molprobity.biochem.duke.edu).

Korean J. Microbiol 2019;55:9-16 https://doi.org/10.7845/kjm.2019.9005
© 2019 Korean J. Microbiol