Effects of crystal twinning on the ability to solve a macromolecular structure using multiwavelength anomalous diffraction

Acta Crystallogr D Biol Crystallogr. 2000 Aug;56(Pt 8):959-64. doi: 10.1107/s0907444900007162.

Abstract

The crystal structure of gpD, the capsid-stabilizing protein of bacteriophage lambda, was solved by multiwavelength anomalous diffraction (MAD) for a selenomethionine (SeMet) derivative of the protein at 1.8 A resolution, using crystals in space group P2(1) [Yang et al. (2000), Nature Struct. Biol. 7, 230-237]. Subsequent analysis showed that the crystals of both the original protein and the SeMet derivative were pseudo-merohedrally twinned with a twinning fraction approximately 0.36, owing to the near-identity of the a and c axes. An analysis of the crystal structure solution is presented and the utility of twinned crystals for solving the structure using MAD and of different phasing strategies is discussed; the results obtained with several software packages are compared.

Publication types

  • Comparative Study

MeSH terms

  • Capsid / chemistry*
  • Capsid Proteins*
  • Crystallization
  • Crystallography, X-Ray / methods
  • Glycoproteins / chemistry*
  • Macromolecular Substances
  • Selenomethionine
  • Software
  • Static Electricity

Substances

  • Capsid Proteins
  • Glycoproteins
  • Macromolecular Substances
  • gpD protein, lambda phage
  • Selenomethionine