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8VEC
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BU of 8vec by Molmil
Deep Mutational Scanning of SARS-CoV-2 PLpro
Descriptor: Papain-like protease nsp3, ZINC ION
Authors:Wu, X, Nguyen, J.V, Call, M.E, Call, M.J.
Deposit date:2023-12-18
Release date:2024-03-20
Method:X-RAY DIFFRACTION (2 Å)
Cite:Mutational Profiling of SARS-CoV-2 PLpro in human cells reveals requirements for function, structure, and drug escape
Biorxiv, 2024
7TB6
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BU of 7tb6 by Molmil
Structure of S. maltophilia CapW
Descriptor: S. maltophilia CapW, SULFATE ION
Authors:Blankenchip, C.L, Nguyen, J.V, Lau, R.K, Ye, Q, Corbett, K.D.
Deposit date:2021-12-21
Release date:2022-01-19
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.89 Å)
Cite:Control of bacterial immune signaling by a WYL domain transcription factor.
Nucleic Acids Res., 50, 2022
7TB5
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BU of 7tb5 by Molmil
Structure of P. aeruginosa PA17 CapW
Descriptor: SULFATE ION, WYL domain-containing protein
Authors:Blankenchip, C.L, Nguyen, J.V, Lau, R.K, Ye, Q, Corbett, K.D.
Deposit date:2021-12-21
Release date:2022-01-19
Last modified:2022-06-01
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Control of bacterial immune signaling by a WYL domain transcription factor.
Nucleic Acids Res., 50, 2022
6WA0
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BU of 6wa0 by Molmil
De novo designed receptor transmembrane domains enhance CAR-T cytotoxicity and attenuate cytokine release
Descriptor: De novo designed receptor transmembrane domain proMP C3.1
Authors:Call, M.J, Call, M.E, Chandler, N.J, Nguyen, J.V, Trenker, R.
Deposit date:2020-03-24
Release date:2021-03-31
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (3.484 Å)
Cite:De novo designed receptor transmembrane domains enhance CAR-T cytotoxicity and attenuate cytokine release
To Be Published
6W9Y
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BU of 6w9y by Molmil
De novo designed receptor transmembrane domains enhance CAR-T cytotoxicity and attenuate cytokine release
Descriptor: (2S)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, De novo designed receptor transmembrane domain proMP 1.2
Authors:Call, M.J, Call, M.E, Chandler, N.J, Nguyen, J.V, Trenker, R.
Deposit date:2020-03-24
Release date:2021-03-31
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.55 Å)
Cite:De novo designed receptor transmembrane domains enhance CAR-T cytotoxicity and attenuate cytokine release
To Be Published
6W9Z
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BU of 6w9z by Molmil
De novo designed receptor transmembrane domains enhance CAR-T cytotoxicity and attenuate cytokine release
Descriptor: (2S)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, De novo designed receptor transmembrane domain ProMP C2.1
Authors:Call, M.J, Call, M.E, Chandler, N.J, Nguyen, J.V, Trenker, R.
Deposit date:2020-03-24
Release date:2021-03-31
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:De novo designed receptor transmembrane domains enhance CAR-T cytotoxicity and attenuate cytokine release
To Be Published
7RKT
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BU of 7rkt by Molmil
Naegleria fowleri CYP51 (NfCYP51) complex with (S)-1-(2,4-dichlorophenyl)-2-(1H-imidazol-1-yl)ethyl 3-(trifluoromethyl)benzoate
Descriptor: (1S)-1-(2,4-dichlorophenyl)-2-(1H-imidazol-1-yl)ethyl 3-(trifluoromethyl)benzoate, GLYCEROL, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Sharma, V, Podust, L.M.
Deposit date:2021-07-22
Release date:2022-07-27
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Miconazole-like Scaffold is a Promising Lead for Naegleria fowleri -Specific CYP51 Inhibitors.
J.Med.Chem., 2023
7RKW
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BU of 7rkw by Molmil
Naegleria fowleri CYP51(NfCYP51) complex with (S)-1-(4-fluorophenyl)-2-(1H-imidazol-1-yl)ethyl 3,5-dichlorobenzoate
Descriptor: (1S)-1-(4-fluorophenyl)-2-(1H-imidazol-1-yl)ethyl 3,5-dichlorobenzoate, GLYCEROL, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Sharma, V, Podust, L.M.
Deposit date:2021-07-22
Release date:2022-07-27
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (1.81 Å)
Cite:Miconazole-like Scaffold is a Promising Lead for Naegleria fowleri -Specific CYP51 Inhibitors.
J.Med.Chem., 2023
7RKR
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BU of 7rkr by Molmil
Naegleria fowleri CYP51 (NfCYP51) complex with (S)-1-(4-fluorophenyl)-2-(1H-imidazol-1-yl)ethyl 3-(trifluoromethyl)benzoate
Descriptor: (1S)-1-(4-fluorophenyl)-2-(1H-imidazol-1-yl)ethyl 3-(trifluoromethyl)benzoate, CALCIUM ION, PROTOPORPHYRIN IX CONTAINING FE, ...
Authors:Sharma, V, Podust, L.M.
Deposit date:2021-07-22
Release date:2022-07-27
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (1.76 Å)
Cite:Miconazole-like Scaffold is a Promising Lead for Naegleria fowleri -Specific CYP51 Inhibitors.
J.Med.Chem., 2023
6W9O
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BU of 6w9o by Molmil
Crystal structure of an OTU deubiquitinase from Wolbachia pipientis wMel
Descriptor: ACETATE ION, OTU domain-containing protein wMelOTU
Authors:Schubert, A.F, Pruneda, J.N, Komander, D.
Deposit date:2020-03-23
Release date:2020-07-01
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.47 Å)
Cite:Identification and characterization of diverse OTU deubiquitinases in bacteria.
Embo J., 39, 2020
6W9S
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BU of 6w9s by Molmil
Crystal structure of an OTU deubiquitinase from Escherichia albertii bound to ubiquitin
Descriptor: FORMIC ACID, OTU domain-containing protein EschOTU, Ubiquitin
Authors:Schubert, A.F, Pruneda, J.N, Komander, D.
Deposit date:2020-03-23
Release date:2020-07-01
Last modified:2020-08-12
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Identification and characterization of diverse OTU deubiquitinases in bacteria.
Embo J., 39, 2020
6W9R
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BU of 6w9r by Molmil
Crystal structure of an OTU deubiquitinase from Wolbachia pipientis wMel bound to ubiquitin
Descriptor: CITRATE ANION, OTU domain-containing protein wMelOTU, Ubiquitin
Authors:Schubert, A.F, Pruneda, J.N, Komander, D.
Deposit date:2020-03-23
Release date:2020-07-01
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.82 Å)
Cite:Identification and characterization of diverse OTU deubiquitinases in bacteria.
Embo J., 39, 2020
7T5U
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BU of 7t5u by Molmil
Structure of E. coli MS115-1 CapH N-terminal domain
Descriptor: Helix-turn-helix domain-containing protein, SULFATE ION
Authors:Lau, R.K, Corbett, K.D.
Deposit date:2021-12-13
Release date:2022-09-14
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.02 Å)
Cite:A conserved signaling pathway activates bacterial CBASS immune signaling in response to DNA damage.
Embo J., 41, 2022
7T5T
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BU of 7t5t by Molmil
Structure of Thauera sp. K11 CapP
Descriptor: 2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID, CapP toxin, SULFATE ION, ...
Authors:Lau, R.K, Corbett, K.D.
Deposit date:2021-12-13
Release date:2022-09-14
Last modified:2024-05-22
Method:X-RAY DIFFRACTION (1.35 Å)
Cite:A conserved signaling pathway activates bacterial CBASS immune signaling in response to DNA damage.
Embo J., 41, 2022
7T5W
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BU of 7t5w by Molmil
Structure of E. coli CapH C-terminal domain
Descriptor: Helix-turn-helix domain-containing protein
Authors:Lau, R.K, Corbett, K.D.
Deposit date:2021-12-13
Release date:2022-09-14
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:A conserved signaling pathway activates bacterial CBASS immune signaling in response to DNA damage.
Embo J., 41, 2022
7T5V
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BU of 7t5v by Molmil
Structure of E. coli CapH C-terminal domain I99M mutant
Descriptor: Helix-turn-helix domain-containing protein
Authors:Lau, R.K, Corbett, K.D.
Deposit date:2021-12-13
Release date:2022-09-14
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.26 Å)
Cite:A conserved signaling pathway activates bacterial CBASS immune signaling in response to DNA damage.
Embo J., 41, 2022
7UYG
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BU of 7uyg by Molmil
Structure of the first OTU domain from Legionella pneumophila effector protein LotA
Descriptor: GLYCEROL, IODIDE ION, LotA
Authors:Pruneda, J.N.
Deposit date:2022-05-06
Release date:2022-12-21
Last modified:2024-05-22
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Mechanism of Lys6 poly-ubiquitin specificity by the L. pneumophila deubiquitinase LotA.
Mol.Cell, 83, 2023
7UYH
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BU of 7uyh by Molmil
Structure of the first OTU domain from Legionella pneumophila effector protein LotA bound to K6-linked diUb
Descriptor: LotA, Ubiquitin
Authors:Warren, G.D, Pruneda, J.N.
Deposit date:2022-05-06
Release date:2022-12-21
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Mechanism of Lys6 poly-ubiquitin specificity by the L. pneumophila deubiquitinase LotA.
Mol.Cell, 83, 2023

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PDB entries from 2024-06-12

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