Gregory Thatcher

cryo-EM structure of thioredoxin glutathione reductase in complex with a non-competitive inhibitor

Petukhova, V. Z. (Contributor), Aboagye, S. Y. (Contributor), Ardini, M. (Contributor), Lullo, R. P. (Contributor), Fata, F. (Contributor), Byrne, M. E. (Contributor), Gabriele, F. (Contributor), Martin, L. M. (Contributor), Harding, L. N. M. (Contributor), Gone, V. (Contributor), Dangi, B. (Contributor), Lantvit, D. D. (Contributor), Nikolic, D. (Contributor), Ippoliti, R. (Contributor), Effantin, G. (Contributor), Ling, W. L. (Contributor), Johnson, J. J. (Contributor), Thatcher, G. R. J. (Contributor), Angelucci, F. (Contributor), Williams, D. L. (Contributor) & Petukhov, P. A. (Contributor), Protein Data Bank (PDB), Jun 14 2023

DOI: 10.2210/pdb8A1R/pdb, https://www.wwpdb.org/pdb?id=pdb_00008a1r

Dataset

Thioredoxin glutathione reductase from Schistosoma mansoni in complex with Indole-3-carbinol

Fata, F. (Contributor), Silvestri, I. (Contributor), Ardini, M. (Contributor), Ippoliti, R. (Contributor), Di Leandro, L. (Contributor), Demitri, N. (Contributor), Polentarutti, M. (Contributor), Di Matteo, A. (Contributor), Lyu, H. (Contributor), Thatcher, G. R. J. (Contributor), Petukhov, P. A. (Contributor), Williams, D. L. (Contributor) & Angelucci, F. (Contributor), Protein Data Bank (PDB), May 19 2021

DOI: 10.2210/pdb6ZLB/pdb, https://www.wwpdb.org/pdb?id=pdb_00006zlb

Dataset

SARS-CoV-2 papain-like protease (PLpro) bound to inhibitor XR8-65

Shen, Z. (Contributor), Ratia, K. (Contributor), Cooper, L. (Contributor), Kong, D. (Contributor), Lee, H. (Contributor), Kwon, Y. (Contributor), Li, Y. (Contributor), Alqarni, S. (Contributor), Huang, F. (Contributor), Dubrovskyi, O. (Contributor), Rong, L. (Contributor), Thatcher, G. (Contributor) & Xiong, R. (Contributor), Protein Data Bank (PDB), Feb 24 2021

DOI: 10.2210/pdb7LOS/pdb, https://www.wwpdb.org/pdb?id=pdb_00007los

Dataset

SARS-CoV-2 papain-like protease (PLpro) bound to inhibitor XR8-69

Shen, Z. (Contributor), Ratia, K. (Contributor), Cooper, L. (Contributor), Kong, D. (Contributor), Lee, H. (Contributor), Kwon, Y. (Contributor), Li, Y. (Contributor), Alqarni, S. (Contributor), Huang, F. (Contributor), Dubrovskyi, O. (Contributor), Rong, L. (Contributor), Thatcher, G. (Contributor) & Xiong, R. (Contributor), Protein Data Bank (PDB), Feb 24 2021

DOI: 10.2210/pdb7LLZ/pdb, https://www.wwpdb.org/pdb?id=pdb_00007llz

Dataset

Human NAMPT in complex with small molecule activator ZN-43-S

Ratia, K. M. (Contributor), Shen, Z. (Contributor), Gordon-Blake, J. (Contributor), Lee, H. (Contributor), Laham, M. S. (Contributor), Krider, I. S. (Contributor), Christie, N. (Contributor), Ackerman-Berrier, M. (Contributor), Penton, C. (Contributor), Knowles, N. G. (Contributor), Musku, S. R. (Contributor), Fu, J. (Contributor), Velma, G. R. (Contributor), Xiong, R. (Contributor) & Thatcher, G. R. J. (Contributor), Protein Data Bank (PDB), Mar 8 2023

DOI: 10.2210/pdb8DTJ/pdb, https://www.wwpdb.org/pdb?id=pdb_00008dtj

Dataset

Human NAMPT in complex with substrate NAM

Ratia, K. M. (Contributor), Shen, Z. (Contributor), Gordon-Blake, J. (Contributor), Lee, H. (Contributor), Laham, M. S. (Contributor), Krider, I. S. (Contributor), Christie, N. (Contributor), Ackerman-Berrier, M. (Contributor), Penton, C. (Contributor), Knowles, N. G. (Contributor), Musku, S. R. (Contributor), Fu, J. (Contributor), Velma, G. R. (Contributor), Xiong, R. (Contributor) & Thatcher, G. R. J. (Contributor), Protein Data Bank (PDB), Mar 8 2023

DOI: 10.2210/pdb8DSI/pdb, https://www.wwpdb.org/pdb?id=pdb_00008dsi

Dataset

Human NAMPT in complex with quercitrin and AMPcP

Ratia, K. M. (Contributor), Shen, Z. (Contributor), Gordon-Blake, J. (Contributor), Lee, H. (Contributor), Laham, M. S. (Contributor), Krider, I. S. (Contributor), Christie, N. (Contributor), Ackerman-Berrier, M. (Contributor), Penton, C. (Contributor), Knowles, N. G. (Contributor), Musku, S. R. (Contributor), Fu, J. (Contributor), Velma, G. R. (Contributor), Xiong, R. (Contributor) & Thatcher, G. R. J. (Contributor), Protein Data Bank (PDB), Mar 8 2023

DOI: 10.2210/pdb8DSH/pdb, https://www.wwpdb.org/pdb?id=pdb_00008dsh

Dataset

Thioredoxin glutathione reductase from Schistosoma mansoni in complex with 3-(3-Methoxyquinoxalin-2-yl)propanoic acid at 24 hours of soaking

Fata, F. (Contributor), Silvestri, I. (Contributor), Ardini, M. (Contributor), Ippoliti, R. (Contributor), Di Leandro, L. (Contributor), Demitri, N. (Contributor), Polentarutti, M. (Contributor), Di Matteo, A. (Contributor), Lyu, H. (Contributor), Thatcher, G. R. J. (Contributor), Petukhov, P. A. (Contributor), Williams, D. L. (Contributor) & Angelucci, F. (Contributor), Protein Data Bank (PDB), May 19 2021

DOI: 10.2210/pdb7NPX/pdb, https://www.wwpdb.org/pdb?id=pdb_00007npx

Dataset

Thioredoxin glutathione reductase from Schistosoma mansoni in complex with 4-Hydroxy-7-methyl-1,8-naphthyridine-3-carboxylic acid

Fata, F. (Contributor), Silvestri, I. (Contributor), Ardini, M. (Contributor), Ippoliti, R. (Contributor), Di Leandro, L. (Contributor), Demitri, N. (Contributor), Polentarutti, M. (Contributor), Di Matteo, A. (Contributor), Lyu, H. (Contributor), Thatcher, G. R. J. (Contributor), Petukhov, P. A. (Contributor), Williams, D. L. (Contributor) & Angelucci, F. (Contributor), Protein Data Bank (PDB), May 19 2021

DOI: 10.2210/pdb7B02/pdb, https://www.wwpdb.org/pdb?id=pdb_00007b02

Dataset

Thioredoxin glutathione reductase from Schistosoma mansoni in complex with 3-(3-methoxyquinoxalin-2-yl)propanoic acid

Fata, F. (Contributor), Silvestri, I. (Contributor), Ardini, M. (Contributor), Ippoliti, R. (Contributor), Di Leandro, L. (Contributor), Demitri, N. (Contributor), Polentarutti, M. (Contributor), Di Matteo, A. (Contributor), Lyu, H. (Contributor), Thatcher, G. R. J. (Contributor), Petukhov, P. A. (Contributor), Williams, D. L. (Contributor) & Angelucci, F. (Contributor), Protein Data Bank (PDB), May 19 2021

DOI: 10.2210/pdb6ZST/pdb, https://www.wwpdb.org/pdb?id=pdb_00006zst

Dataset

SARS-CoV-2 papain-like protease (PLpro) bound to inhibitor XR8-83

Shen, Z. (Contributor), Ratia, K. (Contributor), Cooper, L. (Contributor), Kong, D. (Contributor), Lee, H. (Contributor), Kwon, Y. (Contributor), Li, Y. (Contributor), Alqarni, S. (Contributor), Huang, F. (Contributor), Dubrovskyi, O. (Contributor), Rong, L. (Contributor), Thatcher, G. (Contributor) & Xiong, R. (Contributor), Protein Data Bank (PDB), Feb 24 2021

DOI: 10.2210/pdb7LLF/pdb, https://www.wwpdb.org/pdb?id=pdb_00007llf

Dataset

Estrogen Receptor Alpha Ligand Binding Domain Y537S in Complex with TTC-352 and GRIP Peptide

Abderrahman, B. (Contributor), Maximov, P. Y. (Contributor), Curpan, R. F. (Contributor), Fanning, S. W. (Contributor), Hanspal, J. S. (Contributor), Fan, P. (Contributor), Foulds, C. E. (Contributor), Chen, Y. (Contributor), Malovannaya, A. (Contributor), Jain, A. (Contributor), Xiong, R. (Contributor), Greene, G. L. (Contributor), Tonetti, D. A. (Contributor), Thatcher, G. R. J. (Contributor) & Jordan, V. C. (Contributor), Protein Data Bank (PDB), Nov 25 2020

DOI: 10.2210/pdb7JHD/pdb, https://www.wwpdb.org/pdb?id=pdb_00007jhd

Dataset

SARS-CoV-2 papain-like protease (PLpro) bound to inhibitor XR8-24

Shen, Z. (Contributor), Ratia, K. (Contributor), Cooper, L. (Contributor), Kong, D. (Contributor), Lee, H. (Contributor), Kwon, Y. (Contributor), Li, Y. (Contributor), Alqarni, S. (Contributor), Huang, F. (Contributor), Dubrovskyi, O. (Contributor), Rong, L. (Contributor), Thatcher, G. (Contributor) & Xiong, R. (Contributor), Protein Data Bank (PDB), Feb 24 2021

DOI: 10.2210/pdb7LBS/pdb, https://www.wwpdb.org/pdb?id=pdb_00007lbs

Dataset

CCDC 2156558: Experimental Crystal Structure Determination

Alqarni, S. (Contributor), Cooper, L. (Contributor), Galvan Achi, J. (Contributor), Bott, R. (Contributor), Sali, V. K. (Contributor), Brown, A. (Contributor), Santarsiero, B. D. (Contributor), Krunic, A. (Contributor), Manicassamy, B. (Contributor), Peet, N. P. (Contributor), Zhang, P. (Contributor), Thatcher, G. R. J. (Contributor), Gaisina, I. N. (Contributor), Rong, L. (Contributor) & Moore, T. W. (Contributor), Cambridge Crystallographic Data Centre, 2022

DOI: 10.5517/ccdc.csd.cc2bd2d7, http://www.ccdc.cam.ac.uk/services/structure_request?id=doi:10.5517/ccdc.csd.cc2bd2d7&sid=DataCite

Dataset

Human NAMPT in complex with substrate NAM and small molecule activator NP-A1-R

Ratia, K. M. (Contributor), Shen, Z. (Contributor), Gordon-Blake, J. (Contributor), Lee, H. (Contributor), Laham, M. S. (Contributor), Krider, I. S. (Contributor), Christie, N. (Contributor), Ackerman-Berrier, M. (Contributor), Penton, C. (Contributor), Knowles, N. G. (Contributor), Musku, S. R. (Contributor), Fu, J. (Contributor), Velma, G. R. (Contributor), Xiong, R. (Contributor) & Thatcher, G. R. J. (Contributor), Protein Data Bank (PDB), Mar 8 2023

DOI: 10.2210/pdb8DSC/pdb, https://www.wwpdb.org/pdb?id=pdb_00008dsc

Dataset

Thioredoxin glutathione reductase from Schistosoma mansoni in complex with 4-Aminopiazthiole

Fata, F. (Contributor), Silvestri, I. (Contributor), Ardini, M. (Contributor), Ippoliti, R. (Contributor), Di Leandro, L. (Contributor), Demitri, N. (Contributor), Polentarutti, M. (Contributor), Di Matteo, A. (Contributor), Lyu, H. (Contributor), Thatcher, G. R. J. (Contributor), Petukhov, P. A. (Contributor), Williams, D. L. (Contributor) & Angelucci, F. (Contributor), Protein Data Bank (PDB), May 19 2021

DOI: 10.2210/pdb6ZLP/pdb, https://www.wwpdb.org/pdb?id=pdb_00006zlp

Dataset

Human NAMPT in complex with substrate NAM and small molecule activator NP-A1-S

Ratia, K. M. (Contributor), Shen, Z. (Contributor), Gordon-Blake, J. (Contributor), Lee, H. (Contributor), Laham, M. S. (Contributor), Krider, I. S. (Contributor), Christie, N. (Contributor), Ackerman-Berrier, M. (Contributor), Penton, C. (Contributor), Knowles, N. G. (Contributor), Musku, S. R. (Contributor), Fu, J. (Contributor), Velma, G. R. (Contributor), Xiong, R. (Contributor) & Thatcher, G. R. J. (Contributor), Protein Data Bank (PDB), Mar 8 2023

DOI: 10.2210/pdb8DSD/pdb, https://www.wwpdb.org/pdb?id=pdb_00008dsd

Dataset

Human NAMPT in complex with substrate NAM and activator quercitrin

Ratia, K. M. (Contributor), Shen, Z. (Contributor), Gordon-Blake, J. (Contributor), Lee, H. (Contributor), Laham, M. S. (Contributor), Krider, I. S. (Contributor), Christie, N. (Contributor), Ackerman-Berrier, M. (Contributor), Penton, C. (Contributor), Knowles, N. G. (Contributor), Musku, S. R. (Contributor), Fu, J. (Contributor), Velma, G. R. (Contributor), Xiong, R. (Contributor) & Thatcher, G. R. J. (Contributor), Protein Data Bank (PDB), Mar 8 2023

DOI: 10.2210/pdb8DSE/pdb, https://www.wwpdb.org/pdb?id=pdb_00008dse

Dataset

SARS-CoV-2 papain-like protease (PLpro) bound to inhibitor XR8-89

Shen, Z. (Contributor), Ratia, K. (Contributor), Cooper, L. (Contributor), Kong, D. (Contributor), Lee, H. (Contributor), Kwon, Y. (Contributor), Li, Y. (Contributor), Alqarni, S. (Contributor), Huang, F. (Contributor), Dubrovskyi, O. (Contributor), Rong, L. (Contributor), Thatcher, G. (Contributor) & Xiong, R. (Contributor), Protein Data Bank (PDB), Feb 24 2021

DOI: 10.2210/pdb7LBR/pdb, https://www.wwpdb.org/pdb?id=pdb_00007lbr

Dataset

Thioredoxin glutathione reductase from Schistosoma mansoni in complex with 2-Methylindole-3-acetic acid

Fata, F. (Contributor), Silvestri, I. (Contributor), Ardini, M. (Contributor), Ippoliti, R. (Contributor), Di Leandro, L. (Contributor), Demitri, N. (Contributor), Polentarutti, M. (Contributor), Di Matteo, A. (Contributor), Lyu, H. (Contributor), Thatcher, G. R. J. (Contributor), Petukhov, P. A. (Contributor), Williams, D. L. (Contributor) & Angelucci, F. (Contributor), Protein Data Bank (PDB), May 19 2021

DOI: 10.2210/pdb6ZP3/pdb, https://www.wwpdb.org/pdb?id=pdb_00006zp3

Dataset

CBP bromodomain complexed with YF2-23

Principe, D. R. (Contributor), Xiong, R. (Contributor), Li, Y. (Contributor), Pham, T. N. D. (Contributor), Kamath, S. D. (Contributor), Dubrovskyi, O. (Contributor), Ratia, K. (Contributor), Huang, F. (Contributor), Zhao, J. (Contributor), Shen, Z. (Contributor), Thummuri, D. (Contributor), Daohong, Z. (Contributor), Underwood, P. W. (Contributor), Trevino, J. (Contributor), Munshi, H. G. (Contributor), Thatcher, G. R. J. (Contributor), Rana, A. (Contributor), Gutgesell, L. M. (Contributor), Dye, K. (Contributor), Zhao, H. (Contributor) & Tonetti, D. A. (Contributor), Protein Data Bank (PDB), Sep 1 2021

DOI: 10.2210/pdb7JUO/pdb, https://www.wwpdb.org/pdb?id=pdb_00007juo

Dataset

Gregory Thatcher

Datasets

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