Datasets
- 13 results
Search results
-
Virtual screening for novel SARS-CoV-2 main protease non-covalent and covalent inhibitors
Fink, E. A. (Contributor), Bardine, C. (Contributor), Gahbauer, S. (Contributor), Singh, I. (Contributor), Detomasi, T. C. (Contributor), White, K. (Contributor), Gu, S. (Contributor), Wan, X. (Contributor), Chen, J. (Contributor), Ary, B. (Contributor), Glenn, I. (Contributor), O'Connell, J. (Contributor), O'Donnell, H. (Contributor), Fajtová, P. (Contributor), Lyu, J. (Contributor), Vigneron, S. (Contributor), Young, N. J. (Contributor), Kondratov, I. S. (Contributor), Alisoltani, A. (Contributor), Simons, L. M. (Contributor), Lorenzo-Redondo, R. (Contributor), Ozer, E. A. (Contributor), Hultquist, J. F. (Contributor), O'Donoghue, A. J. (Contributor), Moroz, Y. S. (Contributor), Taunton, J. (Contributor), Renslo, A. R. (Contributor), Irwin, J. J. (Contributor), García-Sastre, A. (Contributor), Shoichet, B. K. (Contributor) & Craik, C. S. (Contributor), Protein Data Bank (PDB), Jun 28 2023
DOI: 10.2210/pdb8DIF/pdb, https://www.wwpdb.org/pdb?id=pdb_00008dif
Dataset
-
Virtual screening for novel SARS-CoV-2 main protease non-covalent and covalent inhibitors
Fink, E. A. (Contributor), Bardine, C. (Contributor), Gahbauer, S. (Contributor), Singh, I. (Contributor), Detomasi, T. C. (Contributor), White, K. (Contributor), Gu, S. (Contributor), Wan, X. (Contributor), Chen, J. (Contributor), Ary, B. (Contributor), Glenn, I. (Contributor), O'Connell, J. (Contributor), O'Donnell, H. (Contributor), Fajtová, P. (Contributor), Lyu, J. (Contributor), Vigneron, S. (Contributor), Young, N. J. (Contributor), Kondratov, I. S. (Contributor), Alisoltani, A. (Contributor), Simons, L. M. (Contributor), Lorenzo-Redondo, R. (Contributor), Ozer, E. A. (Contributor), Hultquist, J. F. (Contributor), O'Donoghue, A. J. (Contributor), Moroz, Y. S. (Contributor), Taunton, J. (Contributor), Renslo, A. R. (Contributor), Irwin, J. J. (Contributor), García-Sastre, A. (Contributor), Shoichet, B. K. (Contributor) & Craik, C. S. (Contributor), Protein Data Bank (PDB), Jun 28 2023
DOI: 10.2210/pdb8DIH/pdb, https://www.wwpdb.org/pdb?id=pdb_00008dih
Dataset
-
Virtual screening for novel SARS-CoV-2 main protease non-covalent and covalent inhibitors
Fink, E. A. (Contributor), Bardine, C. (Contributor), Gahbauer, S. (Contributor), Singh, I. (Contributor), Detomasi, T. C. (Contributor), White, K. (Contributor), Gu, S. (Contributor), Wan, X. (Contributor), Chen, J. (Contributor), Ary, B. (Contributor), Glenn, I. (Contributor), O'Connell, J. (Contributor), O'Donnell, H. (Contributor), Fajtová, P. (Contributor), Lyu, J. (Contributor), Vigneron, S. (Contributor), Young, N. J. (Contributor), Kondratov, I. S. (Contributor), Alisoltani, A. (Contributor), Simons, L. M. (Contributor), Lorenzo-Redondo, R. (Contributor), Ozer, E. A. (Contributor), Hultquist, J. F. (Contributor), O'Donoghue, A. J. (Contributor), Moroz, Y. S. (Contributor), Taunton, J. (Contributor), Renslo, A. R. (Contributor), Irwin, J. J. (Contributor), García-Sastre, A. (Contributor), Shoichet, B. K. (Contributor) & Craik, C. S. (Contributor), Protein Data Bank (PDB), Jun 28 2023
DOI: 10.2210/pdb8DII/pdb, https://www.wwpdb.org/pdb?id=pdb_00008dii
Dataset
-
N74D mutant of the HIV-1 capsid protein in complex with PF-3450074 (PF74)
Selyutina, A. (Contributor), Simons, L. M. (Contributor), Kirby, K. A. (Contributor), Bulnes-Ramos, A. (Contributor), Hu, P. (Contributor), Sarafianos, S. G. (Contributor), Hultquist, J. F. (Contributor) & Diaz-Griffero, F. (Contributor), Protein Data Bank (PDB), May 4 2022
DOI: 10.2210/pdb7MKC/pdb, https://www.wwpdb.org/pdb?id=pdb_00007mkc
Dataset
-
Data from: Live imaging of SARS-CoV-2 infected airway epithelium cultures
Chanda, S. K. (Creator), McRaven, M. D. (Creator), Martin-Sancho, L. (Creator), Hultquist, J. F. (Creator), Hope, T. J. (Creator) & Simons, L. M. (Creator), Dryad, Oct 7 2024
DOI: 10.5061/dryad.7wm37pw0r, https://datadryad.org/stash/dataset/doi:10.5061/dryad.7wm37pw0r
Dataset
-
Virtual screening for novel SARS-CoV-2 main protease non-covalent and covalent inhibitors
Fink, E. A. (Contributor), Bardine, C. (Contributor), Gahbauer, S. (Contributor), Singh, I. (Contributor), Detomasi, T. C. (Contributor), White, K. (Contributor), Gu, S. (Contributor), Wan, X. (Contributor), Chen, J. (Contributor), Ary, B. (Contributor), Glenn, I. (Contributor), O'Connell, J. (Contributor), O'Donnell, H. (Contributor), Fajtová, P. (Contributor), Lyu, J. (Contributor), Vigneron, S. (Contributor), Young, N. J. (Contributor), Kondratov, I. S. (Contributor), Alisoltani, A. (Contributor), Simons, L. M. (Contributor), Lorenzo-Redondo, R. (Contributor), Ozer, E. A. (Contributor), Hultquist, J. F. (Contributor), O'Donoghue, A. J. (Contributor), Moroz, Y. S. (Contributor), Taunton, J. (Contributor), Renslo, A. R. (Contributor), Irwin, J. J. (Contributor), García-Sastre, A. (Contributor), Shoichet, B. K. (Contributor) & Craik, C. S. (Contributor), Protein Data Bank (PDB), Jun 28 2023
DOI: 10.2210/pdb8DIC/pdb, https://www.wwpdb.org/pdb?id=pdb_00008dic
Dataset
-
Virtual screening for novel SARS-CoV-2 main protease non-covalent and covalent inhibitors
Fink, E. A. (Contributor), Bardine, C. (Contributor), Gahbauer, S. (Contributor), Singh, I. (Contributor), Detomasi, T. C. (Contributor), White, K. (Contributor), Gu, S. (Contributor), Wan, X. (Contributor), Chen, J. (Contributor), Ary, B. (Contributor), Glenn, I. (Contributor), O'Connell, J. (Contributor), O'Donnell, H. (Contributor), Fajtová, P. (Contributor), Lyu, J. (Contributor), Vigneron, S. (Contributor), Young, N. J. (Contributor), Kondratov, I. S. (Contributor), Alisoltani, A. (Contributor), Simons, L. M. (Contributor), Lorenzo-Redondo, R. (Contributor), Ozer, E. A. (Contributor), Hultquist, J. F. (Contributor), O'Donoghue, A. J. (Contributor), Moroz, Y. S. (Contributor), Taunton, J. (Contributor), Renslo, A. R. (Contributor), Irwin, J. J. (Contributor), García-Sastre, A. (Contributor), Shoichet, B. K. (Contributor) & Craik, C. S. (Contributor), Protein Data Bank (PDB), Jun 28 2023
DOI: 10.2210/pdb8DIE/pdb, https://www.wwpdb.org/pdb?id=pdb_00008die
Dataset
-
Virtual screening for novel SARS-CoV-2 main protease non-covalent and covalent inhibitors
Fink, E. A. (Contributor), Bardine, C. (Contributor), Gahbauer, S. (Contributor), Singh, I. (Contributor), Detomasi, T. C. (Contributor), White, K. (Contributor), Gu, S. (Contributor), Wan, X. (Contributor), Chen, J. (Contributor), Ary, B. (Contributor), Glenn, I. (Contributor), O'Connell, J. (Contributor), O'Donnell, H. (Contributor), Fajtová, P. (Contributor), Lyu, J. (Contributor), Vigneron, S. (Contributor), Young, N. J. (Contributor), Kondratov, I. S. (Contributor), Alisoltani, A. (Contributor), Simons, L. M. (Contributor), Lorenzo-Redondo, R. (Contributor), Ozer, E. A. (Contributor), Hultquist, J. F. (Contributor), O'Donoghue, A. J. (Contributor), Moroz, Y. S. (Contributor), Taunton, J. (Contributor), Renslo, A. R. (Contributor), Irwin, J. J. (Contributor), García-Sastre, A. (Contributor), Shoichet, B. K. (Contributor) & Craik, C. S. (Contributor), Protein Data Bank (PDB), Jun 28 2023
DOI: 10.2210/pdb8DIG/pdb, https://www.wwpdb.org/pdb?id=pdb_00008dig
Dataset
-
N74D mutant of the HIV-1 capsid protein
Selyutina, A. (Contributor), Simons, L. M. (Contributor), Kirby, K. A. (Contributor), Bulnes-Ramos, A. (Contributor), Hu, P. (Contributor), Sarafianos, S. G. (Contributor), Hultquist, J. F. (Contributor) & Diaz-Griffero, F. (Contributor), Protein Data Bank (PDB), May 4 2022
DOI: 10.2210/pdb7MN0/pdb, https://www.wwpdb.org/pdb?id=pdb_00007mn0
Dataset
-
2.05 Angstrom Resolution Crystal Structure of C-terminal Dimerization Domain of Nucleocapsid Phosphoprotein from SARS-CoV-2
Vandervaart, J. P. (Contributor), Inniss, N. L. (Contributor), Ling-Hu, T. (Contributor), Minasov, G. (Contributor), Wiersum, G. (Contributor), Rosas-Lemus, M. (Contributor), Shuvalova, L. (Contributor), Achenbach, C. J. (Contributor), Hultquist, J. F. (Contributor), Satchell, K. J. F. (Contributor) & Bachta, K. E. R. (Contributor), Protein Data Bank (PDB), Apr 22 2020
DOI: 10.2210/pdb6WJI/pdb, https://www.wwpdb.org/pdb?id=pdb_00006wji
Dataset
-
Virtual screening for novel SARS-CoV-2 main protease non-covalent and covalent inhibitors
Fink, E. A. (Contributor), Bardine, C. (Contributor), Gahbauer, S. (Contributor), Singh, I. (Contributor), Detomasi, T. C. (Contributor), White, K. (Contributor), Gu, S. (Contributor), Wan, X. (Contributor), Chen, J. (Contributor), Ary, B. (Contributor), Glenn, I. (Contributor), O'Connell, J. (Contributor), O'Donnell, H. (Contributor), Fajtová, P. (Contributor), Lyu, J. (Contributor), Vigneron, S. (Contributor), Young, N. J. (Contributor), Kondratov, I. S. (Contributor), Alisoltani, A. (Contributor), Simons, L. M. (Contributor), Lorenzo-Redondo, R. (Contributor), Ozer, E. A. (Contributor), Hultquist, J. F. (Contributor), O'Donoghue, A. J. (Contributor), Moroz, Y. S. (Contributor), Taunton, J. (Contributor), Renslo, A. R. (Contributor), Irwin, J. J. (Contributor), García-Sastre, A. (Contributor), Shoichet, B. K. (Contributor) & Craik, C. S. (Contributor), Protein Data Bank (PDB), Jun 28 2023
DOI: 10.2210/pdb8DIB/pdb, https://www.wwpdb.org/pdb?id=pdb_00008dib
Dataset
-
Virtual screening for novel SARS-CoV-2 main protease non-covalent and covalent inhibitors
Fink, E. A. (Contributor), Bardine, C. (Contributor), Gahbauer, S. (Contributor), Singh, I. (Contributor), Detomasi, T. C. (Contributor), White, K. (Contributor), Gu, S. (Contributor), Wan, X. (Contributor), Chen, J. (Contributor), Ary, B. (Contributor), Glenn, I. (Contributor), O'Connell, J. (Contributor), O'Donnell, H. (Contributor), Fajtová, P. (Contributor), Lyu, J. (Contributor), Vigneron, S. (Contributor), Young, N. J. (Contributor), Kondratov, I. S. (Contributor), Alisoltani, A. (Contributor), Simons, L. M. (Contributor), Lorenzo-Redondo, R. (Contributor), Ozer, E. A. (Contributor), Hultquist, J. F. (Contributor), O'Donoghue, A. J. (Contributor), Moroz, Y. S. (Contributor), Taunton, J. (Contributor), Renslo, A. R. (Contributor), Irwin, J. J. (Contributor), García-Sastre, A. (Contributor), Shoichet, B. K. (Contributor) & Craik, C. S. (Contributor), Protein Data Bank (PDB), Jul 5 2023
DOI: 10.2210/pdb8DID/pdb, https://www.wwpdb.org/pdb?id=pdb_00008did
Dataset
-
Crystal structure of Ebola virus VP30 C-terminus/RBBP6 peptide complex
Batra, J. (Contributor), Hultquist, J. F. (Contributor), Liu, D. (Contributor), Shtanko, O. (Contributor), Von Dollen, J. (Contributor), Satkamp, L. (Contributor), Jang, G. M. (Contributor), Luthra, P. (Contributor), Schwarz, T. M. (Contributor), Small, G. I. (Contributor), Arnett, E. (Contributor), Anantpadma, M. (Contributor), Reyes, A. (Contributor), Leung, D. W. (Contributor), Kaake, R. (Contributor), Haas, P. (Contributor), Schmidt, C. B. (Contributor), Schlesinger, L. S. (Contributor), LaCount, D. J. (Contributor), Davey, R. A. (Contributor), Amarasinghe, G. K. (Contributor), Basler, C. F. (Contributor) & Krogan, N. J. (Contributor), Protein Data Bank (PDB), Dec 12 2018
DOI: 10.2210/pdb6E5X/pdb, https://www.wwpdb.org/pdb?id=pdb_00006e5x
Dataset