CCDC 1948848: Experimental Crystal Structure Determination

  • Zdeněk Dvořák (Contributor)
  • Felix Kopp (Contributor)
  • Cait M. Costello (Contributor)
  • Jazmin S. Kemp (Contributor)
  • Hao Li (Contributor)
  • Aneta Vrzalová (Contributor)
  • Martina Štěpánková (Contributor)
  • Iveta Bartoňková (Contributor)
  • Eva Jiskrová (Contributor)
  • Karolína Poulíková (Contributor)
  • Barbora Vyhlídalová (Contributor)
  • Lars U. Nordstroem (Contributor)
  • Chamini V. Karunaratne (Contributor)
  • Harmit S. Ranhotra (Contributor)
  • Kyu Shik Mun (Contributor)
  • Anjaparavanda P. Naren (Contributor)
  • Iain A. Murray (Contributor)
  • Gary H. Perdew (Contributor)
  • Julius Brtko (Contributor)
  • Lucia Toporova (Contributor)
  • Arne Schön (Contributor)
  • William G. Wallace (Contributor)
  • William G. Walton (Contributor)
  • Matthew R. Redinbo (Contributor)
  • Katherine Sun (Contributor)
  • Amanda Beck (Contributor)
  • Sandhya Kortagere (Contributor)
  • Michelle C. Neary (Contributor)
  • Aneesh Chandran (Contributor)
  • Saraswathi Vishveshwara (Contributor)
  • Maria M. Cavalluzzi (Contributor)
  • Giovanni Lentini (Contributor)
  • Julia Yue Cui (Contributor)
  • Haiwei Gu (Contributor)
  • John C. March (Contributor)
  • Shirshendu Chaterjee (Contributor)
  • Adam Matson (Contributor)
  • Dennis Wright (Contributor)
  • Kyle L. Flannigan (Contributor)
  • Simon A. Hirota (Contributor)
  • Sartor R. Balfour Sartor (Contributor)
  • Sridhar Mani (Contributor)
  • Aneta Vrzalová (Contributor)
  • Lars U. Nordstroem (Contributor)
  • Shirshendu Chatterjee (Contributor)
  • Ryan Balfour Sartor (Contributor)
  • Zdeněk Dvořák (Contributor)
  • Aneta Vrzalová (Contributor)
  • Ryan Balfour Sartor (Contributor)

Dataset

Description

An entry from the Cambridge Structural Database, the world’s repository for small molecule crystal structures. The entry contains experimental data from a crystal diffraction study. The deposited dataset for this entry is freely available from the CCDC and typically includes 3D coordinates, cell parameters, space group, experimental conditions and quality measures.
Date made available2020
PublisherThe Cambridge Structural Database

Access Dataset

  • Targeting the pregnane X receptor using microbial metabolite mimicry

    Dvořák, Z., Kopp, F., Costello, C. M., Kemp, J. S., Li, H., Vrzalová, A., Štěpánková, M., Bartoňková, I., Jiskrová, E., Poulíková, K., Vyhlídalová, B., Nordstroem, L. U., Karunaratne, C. V., Ranhotra, H. S., Mun, K. S., Naren, A. P., Murray, I. A., Perdew, G. H., Brtko, J., Toporova, L., & 22 othersSchön, A., Wallace, W. G., Walton, W. G., Redinbo, M. R., Sun, K., Beck, A., Kortagere, S., Neary, M. C., Chandran, A., Vishveshwara, S., Cavalluzzi, M. M., Lentini, G., Cui, J. Y., Gu, H., March, J. C., Chatterjee, S., Matson, A., Wright, D., Flannigan, K. L., Hirota, S. A., Sartor, R. B. & Mani, S., Apr 7 2020, In: EMBO Molecular Medicine. 12, 4, e11621.

    Research output: Contribution to journal › Article › peer-review

    Open Access
    49 Scopus citations

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