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1TXK
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BU of 1txk by Molmil
Crystal structure of Escherichia coli OpgG
Descriptor: Glucans biosynthesis protein G, SODIUM ION
Authors:Hanoulle, X, Rollet, E, Clantin, B, Landrieu, I, Odberg-Ferragut, C, Lippens, G, Bohin, J.P, Villeret, V.
Deposit date:2004-07-05
Release date:2004-09-07
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structural Analysis of Escherichia coli OpgG, a Protein Required for the Biosynthesis of Osmoregulated Periplasmic Glucans.
J.Mol.Biol., 342, 2004
8AEB
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BU of 8aeb by Molmil
SARS-CoV-2 Main Protease complexed with N-(pyridin-3-ylmethyl)thioformamide
Descriptor: 3C-like proteinase nsp5, DIMETHYL SULFOXIDE, N-(pyridin-3-ylmethyl)thioformamide, ...
Authors:Hanoulle, X, Charton, J, Deprez, B.
Deposit date:2022-07-12
Release date:2023-03-15
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.83 Å)
Cite:Novel dithiocarbamates selectively inhibit 3CL protease of SARS-CoV-2 and other coronaviruses.
Eur.J.Med.Chem., 250, 2023
7P51
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BU of 7p51 by Molmil
CRYSTAL STRUCTURE OF THE SARS-COV-2 MAIN PROTEASE COMPLEXED WITH FRAGMENT F01
Descriptor: 3C-like proteinase, DIMETHYL SULFOXIDE, N-(5-chloropyridin-2-yl)-3-oxo-2,3-dihydro-1H-indene-1-carboxamide, ...
Authors:Hanoulle, X, Moschidi, D.
Deposit date:2021-07-13
Release date:2021-10-06
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.474 Å)
Cite:NMR Spectroscopy of the Main Protease of SARS-CoV-2 and Fragment-Based Screening Identify Three Protein Hotspots and an Antiviral Fragment.
Angew.Chem.Int.Ed.Engl., 60, 2021
7QCQ
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BU of 7qcq by Molmil
VHH Z70 in interaction with PHF6 Tau peptide
Descriptor: GLYCEROL, Tau 301-312, VHH Z70
Authors:Danis, C, Dupre, E, Zejneli, O, Caillierez, R, Arrial, A, Begard, S, Loyens, A, Mortelecque, J, Cantrelle, F.-X, Hanoulle, X, Rain, J.-C, Colin, M, Buee, L, Landrieu, I.
Deposit date:2021-11-25
Release date:2021-12-08
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Inhibition of Tau seeding by targeting Tau nucleation core within neurons with a single domain antibody fragment.
Mol.Ther., 30, 2022
2M5L
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BU of 2m5l by Molmil
Ns5a308
Descriptor: NS5A protein
Authors:Montserret, R, Badillo, A, Hanoulle, X, Lippens, G, Penin, F.
Deposit date:2013-02-27
Release date:2014-03-05
Last modified:2023-06-14
Method:SOLUTION NMR
Cite:Ns5a308
To be Published
5HSV
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BU of 5hsv by Molmil
X-Ray structure of a CypA-Alisporivir complex at 1.5 angstrom resolution
Descriptor: Alisporivir, CHLORIDE ION, Peptidyl-prolyl cis-trans isomerase A
Authors:Dujardin, M, Bouckaert, J, Rucktooa, P, Hanoulle, X.
Deposit date:2016-01-26
Release date:2017-08-16
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:X-ray structure of alisporivir in complex with cyclophilin A at 1.5 angstrom resolution.
Acta Crystallogr F Struct Biol Commun, 74, 2018
6HT4
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BU of 6ht4 by Molmil
NMR Structure of NS5A-D2 (JFH1) peptide (304-323)
Descriptor: NS5A
Authors:Dujardin, M, Cantrelle, F.X, Lippens, G, Hanoulle, X.
Deposit date:2018-10-03
Release date:2019-07-24
Last modified:2023-06-14
Method:SOLUTION NMR
Cite:Cyclophilin A allows the allosteric regulation of a structural motif in the disordered domain 2 of NS5A and thereby fine-tunes HCV RNA replication.
J.Biol.Chem., 294, 2019
7NTS
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BU of 7nts by Molmil
Crystal structure of the SARS-CoV-2 Main Protease with oxidized C145
Descriptor: DIMETHYL SULFOXIDE, FORMIC ACID, GLYCEROL, ...
Authors:Dupre, E, Villeret, V, Hanoulle, X.
Deposit date:2021-03-10
Release date:2021-10-06
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.477 Å)
Cite:NMR Spectroscopy of the Main Protease of SARS-CoV-2 and Fragment-Based Screening Identify Three Protein Hotspots and an Antiviral Fragment.
Angew.Chem.Int.Ed.Engl., 60, 2021
7NLC
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BU of 7nlc by Molmil
Crystallographic structure of human Tsg101 UEV domain in complex with a HEV ORF3 peptide
Descriptor: AMMONIUM ION, CHLORIDE ION, Protein ORF3, ...
Authors:Moschidi, D, Dupre, E, Villeret, V, Hanoulle, X.
Deposit date:2021-02-22
Release date:2022-03-02
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.398 Å)
Cite:Crystallographic structure of human Tsg101 UEV domain in complex with a HEV ORF3 peptide
To Be Published
7NTW
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BU of 7ntw by Molmil
Crystal structure of the SARS-CoV-2 Main Protease with a Zinc ion coordinated in the active site
Descriptor: 3C-like proteinase, DIMETHYL SULFOXIDE, FORMIC ACID, ...
Authors:Dupre, E, Villeret, V, Hanoulle, X.
Deposit date:2021-03-11
Release date:2022-03-02
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.815 Å)
Cite:Crystal structure of the SARS-CoV-2 Main Protease with a Zinc ion coordinated in the active site
To Be Published
7NTT
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BU of 7ntt by Molmil
Crystal structure of the SARS-CoV-2 Main Protease
Descriptor: 3C-like proteinase, FORMIC ACID, SODIUM ION
Authors:Dupre, E, Villeret, V, Hanoulle, X.
Deposit date:2021-03-10
Release date:2022-03-02
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (1.743 Å)
Cite:Crystal structure of the SARS-CoV-2 Main Protease
To Be Published
7NTQ
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BU of 7ntq by Molmil
Crystal structure of the SARS-CoV-2 Main Protease complexed with N-(pyridin-3-ylmethyl)thioformamide
Descriptor: 3C-like proteinase, DIMETHYL SULFOXIDE, FORMIC ACID, ...
Authors:Dupre, E, Villeret, V, Hanoulle, X.
Deposit date:2021-03-10
Release date:2022-03-02
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.495 Å)
Cite:Novel dithiocarbamates selectively inhibit 3CL protease of SARS-CoV-2 and other coronaviruses.
Eur.J.Med.Chem., 250, 2023
8OPI
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BU of 8opi by Molmil
VHH Z70 mutant 1 in interaction with PHF6 Tau peptide
Descriptor: PHF6 Tau peptide, VHH Z70 mutant 1
Authors:Dupre, E, Mortelecque, J, NGuyen, M, Hanoulle, X, Landrieu, I.
Deposit date:2023-04-07
Release date:2023-05-31
Last modified:2024-04-24
Method:X-RAY DIFFRACTION (1.83 Å)
Cite:A selection and optimization strategy for single-domain antibodies targeting the PHF6 linear peptide within the tau intrinsically disordered protein.
J.Biol.Chem., 300, 2024
8OP0
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BU of 8op0 by Molmil
VHH Z70 mutant 20 in interaction with PHF6 Tau peptide
Descriptor: Tau PHF6 peptide, VHH Z70 mutant 20
Authors:Dupre, E, Mortelecque, J, NGuyen, M, Hanoulle, X, Landrieu, I.
Deposit date:2023-04-06
Release date:2023-05-31
Last modified:2024-04-24
Method:X-RAY DIFFRACTION (1.54 Å)
Cite:A selection and optimization strategy for single-domain antibodies targeting the PHF6 linear peptide within the tau intrinsically disordered protein.
J.Biol.Chem., 300, 2024
8PII
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BU of 8pii by Molmil
VHH Z70 mutant 3 in interaction with PHF6 Tau peptide
Descriptor: Microtubule-associated protein tau, VHH Z70 Mutant 3
Authors:Dupre, E, Mortelecque, J, NGuyen, M, Hanoulle, X, Landrieu, I.
Deposit date:2023-06-21
Release date:2023-07-05
Last modified:2024-04-24
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:A selection and optimization strategy for single-domain antibodies targeting the PHF6 linear peptide within the tau intrinsically disordered protein.
J.Biol.Chem., 300, 2024
5ODD
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BU of 5odd by Molmil
HUMAN MED26 N-TERMINAL DOMAIN (1-92)
Descriptor: Mediator of RNA polymerase II transcription subunit 26
Authors:Lens, Z, Cantrelle, F.-X, Perruzini, R, Dewitte, F, Hanoulle, X, Villeret, V, Verger, A, Landrieu, I.
Deposit date:2017-07-05
Release date:2017-11-29
Last modified:2023-06-14
Method:SOLUTION NMR
Cite:1H, 15N and 13C assignments of the N-terminal domain of the Mediator complex subunit MED26.
Biomol.Nmr Assign., 10, 2016

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PDB entries from 2024-04-24

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