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9HJV
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BU of 9hjv by Molmil
Crystal structure of flavin-dependent monooxygenase Tet(X4) in complex with prochlorperazine
Descriptor: 2-chloro-10-[3-(4-methylpiperazin-1-yl)propyl]-10H-phenothiazine, DIHYDROFLAVINE-ADENINE DINUCLEOTIDE, Flavin-dependent monooxygenase, ...
Authors:Beech, M.J, Smith, H.G, Allen, M.D, Farley, A.J.M, Schofield, C.J.
Deposit date:2024-12-02
Release date:2025-05-21
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Binding assays enable discovery of Tet(X) inhibitors that combat tetracycline destructase resistance.
Chem Sci, 2025
9HKE
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BU of 9hke by Molmil
Crystal structure of flavin-dependent monooxygenase Tet(X4) in complex with trifluoperazine
Descriptor: 10-[3-(4-METHYL-PIPERAZIN-1-YL)-PROPYL]-2-TRIFLUOROMETHYL-10H-PHENOTHIAZINE, DIHYDROFLAVINE-ADENINE DINUCLEOTIDE, Flavin-dependent monooxygenase, ...
Authors:Smith, H.G, Beech, M.J, Allen, M.D, Farley, A.J.M, Schofield, C.J.
Deposit date:2024-12-03
Release date:2025-05-21
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Binding assays enable discovery of Tet(X) inhibitors that combat tetracycline destructase resistance.
Chem Sci, 2025
9HJW
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BU of 9hjw by Molmil
Crystal structure of flavin-dependent monooxygenase Tet(X4) in complex with tegaserod
Descriptor: 1-[(~{E})-(5-methoxy-1~{H}-indol-3-yl)methylideneamino]-3-pentyl-guanidine, DIHYDROFLAVINE-ADENINE DINUCLEOTIDE, Flavin-dependent monooxygenase, ...
Authors:Smith, H.G, Beech, M.J, Allen, M.D, Farley, A.J.M, Schofield, C.J.
Deposit date:2024-12-02
Release date:2025-05-21
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Binding assays enable discovery of Tet(X) inhibitors that combat tetracycline destructase resistance.
Chem Sci, 2025
9FZE
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BU of 9fze by Molmil
Pseudomonas aeruginosa penicillin binding protein 3 in complex with meropenem
Descriptor: (4R,5S)-3-{[(3S,5S)-5-(dimethylcarbamoyl)pyrrolidin-3-yl]sulfanyl}-5-[(2S,3R)-3-hydroxy-1-oxobutan-2-yl]-4-methyl-4,5-d ihydro-1H-pyrrole-2-carboxylic acid, Peptidoglycan D,D-transpeptidase FtsI
Authors:Smith, H.G, Allen, M.D, Basak, S, Aniebok, V, Beech, M.J, Alshref, F.M, Farley, A.J.M, Schofield, C.J.
Deposit date:2024-07-05
Release date:2024-10-09
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Structural basis of Pseudomonas aeruginosa penicillin binding protein 3 inhibition by the siderophore-antibiotic cefiderocol.
Chem Sci, 15, 2024
9FZP
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BU of 9fzp by Molmil
Pseudomonas aeruginosa penicillin binding protein 3 in complex with cefepime
Descriptor: CEFOTAXIME, C3' cleaved, open, ...
Authors:Smith, H.G, Allen, M.D, Basak, S, Aniebok, V, Beech, M.J, Alshref, F.M, Farley, A.J.M, Schofield, C.J.
Deposit date:2024-07-05
Release date:2024-10-09
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Structural basis of Pseudomonas aeruginosa penicillin binding protein 3 inhibition by the siderophore-antibiotic cefiderocol.
Chem Sci, 15, 2024
9FZ7
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BU of 9fz7 by Molmil
Pseudomonas aeruginosa penicillin binding protein 3 in complex with cefiderocol
Descriptor: ACYLATED CEFTAZIDIME, Peptidoglycan D,D-transpeptidase FtsI
Authors:Smith, H.G, Allen, M.D, Basak, S, Aniebok, V, Beech, M.J, Alshref, F.M, Farley, A.J.M, Schofield, C.J.
Deposit date:2024-07-04
Release date:2024-10-09
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Structural basis of Pseudomonas aeruginosa penicillin binding protein 3 inhibition by the siderophore-antibiotic cefiderocol.
Chem Sci, 15, 2024
9FZO
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BU of 9fzo by Molmil
Pseudomonas aeruginosa penicillin binding protein 3 in complex with ceftazidime
Descriptor: ACYLATED CEFTAZIDIME, Peptidoglycan D,D-transpeptidase FtsI, SULFATE ION
Authors:Smith, H.G, Allen, M.D, Basak, S, Aniebok, V, Beech, M.J, Alshref, F.M, Farley, A.J.M, Schofield, C.J.
Deposit date:2024-07-05
Release date:2024-10-09
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Structural basis of Pseudomonas aeruginosa penicillin binding protein 3 inhibition by the siderophore-antibiotic cefiderocol.
Chem Sci, 15, 2024
9FZ8
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BU of 9fz8 by Molmil
Pseudomonas aeruginosa penicillin binding protein 3
Descriptor: Peptidoglycan D,D-transpeptidase FtsI
Authors:Smith, H.G, Allen, M.D, Basak, S, Aniebok, V, Beech, M.J, Alshref, F.M, Farley, A.J.M, Schofield, C.J.
Deposit date:2024-07-04
Release date:2024-10-09
Last modified:2024-11-06
Method:X-RAY DIFFRACTION (2.11 Å)
Cite:Structural basis of Pseudomonas aeruginosa penicillin binding protein 3 inhibition by the siderophore-antibiotic cefiderocol.
Chem Sci, 15, 2024
8AQR
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BU of 8aqr by Molmil
Native crystal structure of the N-terminal beta-hairpin docking (bHD) domain of the AerJ halogenase, from the aeruginosin biosynthetic assembly line
Descriptor: AerJ, CHLORIDE ION
Authors:Fage, C.D, Lewandowski, J.R, Challis, G.L.
Deposit date:2022-08-13
Release date:2024-03-06
Method:X-RAY DIFFRACTION (1.46 Å)
Cite:Tandem halogenation and condensation in aeruginosin biosynthesis is directed by docking domain-mediated carrier protein recruitment
To Be Published
8AQQ
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BU of 8aqq by Molmil
SeMet-derived crystal structure of the N-terminal beta-hairpin docking (bHD) domain of the AerJ halogenase, from the aeruginosin biosynthetic assembly line
Descriptor: AerJ, CHLORIDE ION
Authors:Fage, C.D, Lewandowski, J.R, Challis, G.L.
Deposit date:2022-08-13
Release date:2024-03-06
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (1.68 Å)
Cite:Tandem halogenation and condensation in aeruginosin biosynthesis is directed by docking domain-mediated carrier protein recruitment
To Be Published

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PDB entries from 2025-05-28

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