The crystal structures of human S100A12 in apo form and in complex with zinc: new insights into S100A12 oligomerisation

J Mol Biol. 2009 Aug 21;391(3):536-51. doi: 10.1016/j.jmb.2009.06.004. Epub 2009 Jun 6.

Abstract

The functions of the members of the S100 family of EF-hand proteins are modulated by calcium and, in a number of cases, by zinc or copper. One such protein is S100A12, which is implicated in inflammation and host-parasite responses. Previously, we reported the structures of human S100A12 in both low (dimeric) and high (hexameric) calcium forms and, in addition, that of a complex with copper and calcium. Here we report the crystal structures of the metal-free apo form of human S100A12 at 1.77 A resolution and of the zinc complex in two crystal forms (P2(1)2(1)2(1) and F222) to 1.88 A and 1.73 A resolution, respectively. These are the first structures of a zinc-only complex of an S100 protein to be determined. The zinc complex structure shows significant differences from those of both calcium-loaded and apo-S100A12 structures, and comparisons suggest an explanation for the zinc-induced 1500-fold increase in calcium affinity. In addition, the new structures provide insight into the role of zinc-calcium interplay in the transition of S100A12 from a dimer through a tetramer to a hexamer. The role of both zinc and calcium in target binding by S100A12 during host-parasite responses is confirmed by experiments with paramyosin from the tropical parasites Onchocerca volvulus and Brugia malayi.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Amino Acid Sequence
  • Animals
  • Brugia malayi
  • Calcium / metabolism
  • Crystallography, X-Ray
  • Helminth Proteins / chemistry
  • Host-Parasite Interactions
  • Humans
  • Models, Molecular
  • Molecular Sequence Data
  • Onchocerca volvulus
  • Protein Binding
  • Protein Conformation
  • Protein Folding
  • Protein Multimerization
  • S100 Proteins / chemistry*
  • S100 Proteins / metabolism
  • S100A12 Protein
  • Tropomyosin / chemistry
  • Zinc / metabolism*

Substances

  • Helminth Proteins
  • S100 Proteins
  • S100A12 Protein
  • S100A12 protein, human
  • Tropomyosin
  • Zinc
  • Calcium