Crystal structure of deoxycytidylate hydroxymethylase from bacteriophage T4, a component of the deoxyribonucleoside triphosphate-synthesizing complex

EMBO J. 1999 Mar 1;18(5):1104-13. doi: 10.1093/emboj/18.5.1104.

Abstract

Bacteriophage T4 deoxycytidylate hydroxymethylase (EC 2.1.2.8), a homodimer of 246-residue subunits, catalyzes hydroxymethylation of the cytosine base in deoxycytidylate (dCMP) to produce 5-hydroxymethyl-dCMP. It forms part of a phage DNA protection system and appears to function in vivo as a component of a multienzyme complex called deoxyribonucleoside triphosphate (dNTP) synthetase. We have determined its crystal structure in the presence of the substrate dCMP at 1.6 A resolution. The structure reveals a subunit fold and a dimerization pattern in common with thymidylate synthases, despite low (approximately 20%) sequence identity. Among the residues that form the dCMP binding site, those interacting with the sugar and phosphate are arranged in a configuration similar to the deoxyuridylate binding site of thymidylate synthases. However, the residues interacting directly or indirectly with the cytosine base show a more divergent structure and the presumed folate cofactor binding site is more open. Our structure reveals a water molecule properly positioned near C-6 of cytosine to add to the C-7 methylene intermediate during the last step of hydroxymethylation. On the basis of sequence comparison and crystal packing analysis, a hypothetical model for the interaction between T4 deoxycytidylate hydroxymethylase and T4 thymidylate synthase in the dNTP-synthesizing complex has been built.

Publication types

  • Comparative Study
  • Research Support, Non-U.S. Gov't

MeSH terms

  • Amino Acid Sequence
  • Bacteriophage T4 / enzymology*
  • Catalysis
  • Crystallography, X-Ray
  • Deoxycytidine Monophosphate / chemistry
  • Dimerization
  • Hydrogen Bonding
  • Hydroxymethyl and Formyl Transferases / chemistry*
  • Models, Molecular
  • Molecular Sequence Data
  • Nucleotides / metabolism
  • Protein Structure, Secondary
  • Protein Structure, Tertiary
  • Sequence Alignment
  • Static Electricity
  • Thymidylate Synthase / chemistry
  • Viral Proteins / chemistry

Substances

  • Nucleotides
  • Viral Proteins
  • Deoxycytidine Monophosphate
  • Thymidylate Synthase
  • Hydroxymethyl and Formyl Transferases
  • deoxycytidylate hydroxymethyltransferase