X-ray crystallographic determination of the structure of the influenza C virus haemagglutinin-esterase-fusion glycoprotein

Acta Crystallogr D Biol Crystallogr. 1999 May;55(Pt 5):945-61. doi: 10.1107/s0907444999000232.

Abstract

The structure of the haemagglutinin-esterase-fusion (HEF) glycoprotein from influenza C virus has been determined to 3.2 A resolution by X-ray crystallography. A synthetic mercury-containing esterase inhibitor and receptor analogue, 9-acetamidosialic acid alpha-thiomethylmercuryglycoside, was designed as the single isomorphous heavy-atom derivative. The asymmetric unit of one crystal form (form I; P4322, a = b = 155.4, c = 414.4 A) contained an HEF trimer. Six mercury sites identifying the three haemagglutination and three esterase sites were located by difference Patterson map analysis of a 6.5 A resolution derivative data set. These positions defined the molecular threefold-symmetry axis of the HEF trimer. A molecular envelope was defined by averaging a 7.0 A resolution electron-density map, phased by single isomorphous replacement (SIR), about the non-crystallographic threefold-symmetry axis. Iterative non-crystallographic symmetry averaging in real space, solvent flattening and histogram matching were used to extend the phases to 3.5 A resolution. Molecular replacement of the model into a second crystal form (form II; P43212, a = b = 217.4, c = 421.4 A) containing two HEF trimers per asymmetric unit permitted iterative ninefold averaging of the electron density. The 3.5 A electron-density map allowed an unambiguous tracing of the polypeptide chain and identification of N-linked carbohydrates. The model has been refined by least squares to 3.2 A resolution (Rfree = 26.7%).

Publication types

  • Research Support, Non-U.S. Gov't
  • Research Support, U.S. Gov't, P.H.S.

MeSH terms

  • Acetylesterase / chemistry*
  • Binding Sites
  • Crystallography, X-Ray
  • Gammainfluenzavirus / enzymology*
  • Glycoproteins / chemistry*
  • Hemagglutinins, Viral / chemistry*
  • Mercury / chemistry
  • Models, Molecular
  • Protein Conformation
  • Viral Fusion Proteins / chemistry*

Substances

  • Glycoproteins
  • Hemagglutinins, Viral
  • Viral Fusion Proteins
  • hemagglutinin esterase
  • Acetylesterase
  • Mercury

Associated data

  • PDB/1FLC