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STRUCTURE DETERMINATION home > services > structure determination
  Need to know the three-dimensional structure of your molecule? Outsource your structure determination needs with us. Our ground breaking structure solution method, SnB, can solve problems big or small, including structures in excess of 200 atoms.  


Our Basic Analytical Service includes:

  • Crystal mounting (glass fiber or capillary as necessary)
  • Data collection to 55° q with sealed tube CuK a radiation source on a CAD-4 diffractometer
  • Space group determination
  • Structure solution, refinement (including hydrogen atoms)
  • Structure report including molecular ORTEP and packing diagram
  • Structure analysis including bond/angle output and hydrogen bonds (air-stable compounds only)
    The cost is $75 per non-hydrogen atom

Additional Services Available include:

  • Data Collection to 75° q
    • The cost is $25 per non-hydrogen atom
  • Low temperature data collection
    • The cost is $15 per non-hydrogen atom
  • Crystallization
    • The cost is $500
  • Bayesian data analysis
    • The cost is $150
  • Cell constants determination
    • The cost is $200
  • Data collection only
    • The cost is $20 / 100 reflections
  • Image plate images
    • The cost is $50 / image
  • Multiple compound projects
    • Please inquiry about the cost
  • Collaborative or Contract Services
    • Please inquiry about the cost
  • Consultation on Direct Phasing Problems
    • Please inquiry about the cost

      For More Information Contact:
      Dr. Walter Pangborn
      Telephone: (716) 898-8610
      E-mail: pangborn@hwi.buffalo.edu
      Fax: (716) 898-8660
      Hauptman-Woodward Medical Research Institute
      700 Ellicott Street, Buffalo, New York 14203-1102