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7Z97
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Crystal structure of the F191M variant of Variovorax paradoxus indole monooxygenase (VpIndA1) in complex with 6-bromoindole
分子名称: 1,2-ETHANEDIOL, 6-bromo-1H-indole, FLAVIN-ADENINE DINUCLEOTIDE, ...
著者Kratky, J, Weisse, R, Strater, N.
登録日2022-03-20
公開日2023-02-22
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.46 Å)
主引用文献Structural and Mechanistic Studies on Substrate and Stereoselectivity of the Indole Monooxygenase VpIndA1: New Avenues for Biocatalytic Epoxidations and Sulfoxidations.
Angew.Chem.Int.Ed.Engl., 62, 2023
8AP0
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BU of 8ap0 by Molmil
ForT Mutant T138V
分子名称: 1-O-pyrophosphono-5-O-phosphono-alpha-D-ribofuranose, 4-azanyl-1~{H}-pyrazole-3,5-dicarboxylic acid, Beta-ribofuranosylaminobenzene 5'-phosphate synthase, ...
著者Li, W, Naismith, J.H.
登録日2022-08-09
公開日2022-09-07
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Experimental and computational snapshots of C-C bond formation in a C-nucleoside synthase.
Open Biology, 13, 2023
8AOZ
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ForT Mutant L24A
分子名称: 1,2-ETHANEDIOL, 4-azanyl-3-[(2~{S},3~{R},4~{S},5~{R})-3,4-bis(oxidanyl)-5-(phosphonooxymethyl)oxolan-2-yl]-1~{H}-pyrazole-5-carboxylic acid, Beta-ribofuranosylaminobenzene 5'-phosphate synthase, ...
著者Li, W, Naismith, J.H.
登録日2022-08-09
公開日2022-09-07
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Experimental and computational snapshots of C-C bond formation in a C-nucleoside synthase.
Open Biology, 13, 2023
9FKD
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BU of 9fkd by Molmil
Progesterone-bound DB3 Fab in complex with computationally designed DBPro1156_2 protein binder
分子名称: Anti-kappa Fab Heavy Chain, Anti-kappa Fab Light Chain, DB3 Fab Heavy chain, ...
著者Pacesa, M, Marchand, A, Correia, B.E.
登録日2024-06-03
公開日2024-10-30
最終更新日2025-03-26
実験手法ELECTRON MICROSCOPY (3.3 Å)
主引用文献Targeting protein-ligand neosurfaces with a generalizable deep learning tool.
Nature, 639, 2025
7Z94
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Crystal structure of Variovorax paradoxus indole monooxygenase (VpIndA1) in complex with indole
分子名称: DIMETHYL SULFOXIDE, FLAVIN-ADENINE DINUCLEOTIDE, INDOLE, ...
著者Kratky, J, Weisse, R, Strater, N.
登録日2022-03-19
公開日2023-02-22
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.74 Å)
主引用文献Structural and Mechanistic Studies on Substrate and Stereoselectivity of the Indole Monooxygenase VpIndA1: New Avenues for Biocatalytic Epoxidations and Sulfoxidations.
Angew.Chem.Int.Ed.Engl., 62, 2023
7Z99
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BU of 7z99 by Molmil
Crystal structure of F191M variant of Variovorax paradoxus indole monooxygenase (VpIndA1) in complex with methyl phenyl sulfoxide
分子名称: FLAVIN-ADENINE DINUCLEOTIDE, Putative dehydrogenase/oxygenase subunit (Flavoprotein), [(S)-methylsulfinyl]benzene
著者Kratky, J, Weisse, R, Strater, N.
登録日2022-03-20
公開日2023-02-22
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.92 Å)
主引用文献Structural and Mechanistic Studies on Substrate and Stereoselectivity of the Indole Monooxygenase VpIndA1: New Avenues for Biocatalytic Epoxidations and Sulfoxidations.
Angew.Chem.Int.Ed.Engl., 62, 2023
7Z4X
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BU of 7z4x by Molmil
Crystal structure of Variovorax paradoxus indole monooxygenase (VpIndA1) in complex with FAD
分子名称: FLAVIN-ADENINE DINUCLEOTIDE, Putative dehydrogenase/oxygenase subunit (Flavoprotein)
著者Kratky, J, Weisse, R, Strater, N.
登録日2022-03-06
公開日2023-02-22
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Structural and Mechanistic Studies on Substrate and Stereoselectivity of the Indole Monooxygenase VpIndA1: New Avenues for Biocatalytic Epoxidations and Sulfoxidations.
Angew.Chem.Int.Ed.Engl., 62, 2023
7Z98
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Crystal structure of F191M variant Variovorax paradoxus indole monooxygenase (VpIndA1) in complex with methyl phenyl sulfide
分子名称: (methylsulfanyl)benzene, 1,2-ETHANEDIOL, FLAVIN-ADENINE DINUCLEOTIDE, ...
著者Kratky, J, Weisse, R, Strater, N.
登録日2022-03-20
公開日2023-02-22
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.73 Å)
主引用文献Structural and Mechanistic Studies on Substrate and Stereoselectivity of the Indole Monooxygenase VpIndA1: New Avenues for Biocatalytic Epoxidations and Sulfoxidations.
Angew.Chem.Int.Ed.Engl., 62, 2023
7ZCA
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BU of 7zca by Molmil
Crystal structure of the F191M/F201A variant of Variovorax paradoxus indole monooxygenase (VpIndA1) in complex with benzyl phenyl sulfoxide
分子名称: ACETATE ION, FLAVIN-ADENINE DINUCLEOTIDE, Putative dehydrogenase/oxygenase subunit (Flavoprotein), ...
著者Kratky, J, Weisse, R, Strater, N.
登録日2022-03-26
公開日2023-02-22
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.68 Å)
主引用文献Structural and Mechanistic Studies on Substrate and Stereoselectivity of the Indole Monooxygenase VpIndA1: New Avenues for Biocatalytic Epoxidations and Sulfoxidations.
Angew.Chem.Int.Ed.Engl., 62, 2023
8IPJ
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BU of 8ipj by Molmil
Crystal structure of the Legionella effector protein MavL with ADPR-Ub
分子名称: MavL, Ubiquitin, [(2R,3S,4R,5R)-5-(6-AMINOPURIN-9-YL)-3,4-DIHYDROXY-OXOLAN-2-YL]METHYL[HYDROXY-[[(2R,3S,4R,5S)-3,4,5-TRIHYDROXYOXOLAN-2-YL]METHOXY]PHOSPHORYL] HYDROGEN PHOSPHATE
著者Ouyang, S, Guan, H.
登録日2023-03-14
公開日2024-03-20
最終更新日2025-04-09
実験手法X-RAY DIFFRACTION (2.003 Å)
主引用文献Legionella maintains host cell ubiquitin homeostasis by effectors with unique catalytic mechanisms.
Nat Commun, 15, 2024
8IPW
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BU of 8ipw by Molmil
The sturecture of Legionella effector protein MavL with ADPR
分子名称: MavL, [(2R,3S,4R,5R)-5-(6-AMINOPURIN-9-YL)-3,4-DIHYDROXY-OXOLAN-2-YL]METHYL[HYDROXY-[[(2R,3S,4R,5S)-3,4,5-TRIHYDROXYOXOLAN-2-YL]METHOXY]PHOSPHORYL] HYDROGEN PHOSPHATE
著者Ouyang, S, Guan, H.
登録日2023-03-15
公開日2024-03-20
最終更新日2025-04-09
実験手法X-RAY DIFFRACTION (2.35 Å)
主引用文献Legionella maintains host cell ubiquitin homeostasis by effectors with unique catalytic mechanisms.
Nat Commun, 15, 2024
8J9B
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BU of 8j9b by Molmil
LnaB-actin binary complex
分子名称: Actin gamma 1, Type IV secretion protein Dot
著者Chen, T.T, Ouyang, S.Y.
登録日2023-05-03
公開日2024-05-08
最終更新日2025-04-09
実験手法X-RAY DIFFRACTION (3.42 Å)
主引用文献Legionella maintains host cell ubiquitin homeostasis by effectors with unique catalytic mechanisms.
Nat Commun, 15, 2024
9E1R
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BU of 9e1r by Molmil
Snf2h bound nucleosome complex - ClassB4
分子名称: ADENOSINE-5'-DIPHOSPHATE, DNA (152-MER), Histone H2A type 1, ...
著者Malik, D, Deshmukh, A.A, Bilokapic, S, Halic, M.
登録日2024-10-21
公開日2025-01-22
最終更新日2025-05-21
実験手法ELECTRON MICROSCOPY (3.1 Å)
主引用文献Snf2h bound nucleosome complex-ClassB4
To Be Published
9E1W
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BU of 9e1w by Molmil
Snf2h bound nucleosome complex - ClassC3
分子名称: ADENOSINE-5'-DIPHOSPHATE, DNA (151-MER), DNA (152-MER), ...
著者Malik, D, Deshmukh, A.A, Bilokapic, S, Halic, M.
登録日2024-10-21
公開日2025-01-22
最終更新日2025-05-28
実験手法ELECTRON MICROSCOPY (3.2 Å)
主引用文献Snf2h bound nucleosome complex-ClassC3
To Be Published
9E1L
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BU of 9e1l by Molmil
Snf2h bound nucleosome complex - ClassA1
分子名称: ADENOSINE-5'-TRIPHOSPHATE, DNA (149-MER), DNA (151-MER), ...
著者Malik, D, Deshmukh, A.A, Bilokapic, S, Halic, M.
登録日2024-10-21
公開日2025-01-22
最終更新日2025-05-28
実験手法ELECTRON MICROSCOPY (3.15 Å)
主引用文献Snf2h bound nucleosome complex-ClassA1
To Be Published
9E1M
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BU of 9e1m by Molmil
Snf2h bound nucleosome complex - ClassA2
分子名称: ADENOSINE-5'-TRIPHOSPHATE, DNA (149-MER), DNA (151-MER), ...
著者Malik, D, Deshmukh, A.A, Bilokapic, S, Halic, M.
登録日2024-10-21
公開日2025-01-22
最終更新日2025-05-14
実験手法ELECTRON MICROSCOPY (3.25 Å)
主引用文献Snf2h bound nucleosome complex - ClassA2
To Be Published
9E1V
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BU of 9e1v by Molmil
Snf2h bound nucleosome complex - ClassC2
分子名称: ADENOSINE-5'-DIPHOSPHATE, DNA (151-MER), DNA (152-MER), ...
著者Malik, D, Deshmukh, A.A, Bilokapic, S, Halic, M.
登録日2024-10-21
公開日2025-01-22
最終更新日2025-05-21
実験手法ELECTRON MICROSCOPY (3.1 Å)
主引用文献Snf2h bound nucleosome complex-ClassC2
To Be Published
3ATZ
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BU of 3atz by Molmil
Crystal structure of TcOYE with pHBA
分子名称: FLAVIN MONONUCLEOTIDE, P-HYDROXYBENZALDEHYDE, Prostaglandin F2a synthase
著者Okamoto, N, Yamaguchi, K, Mizohata, E, Tokuoka, K, Uchiyama, N, Sugiyama, S, Matsumura, H, Inaka, K, Urade, Y, Inoue, T.
登録日2011-01-26
公開日2012-02-01
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (2.04 Å)
主引用文献Structural insight into the stereoselective production of PGF2(alpha) by Old Yellow Enzyme from Trypanosoma cruzi
J.Biochem., 150, 2011
7D60
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BU of 7d60 by Molmil
Cryo-EM Structure of human CALHM5 in the presence of rubidium red
分子名称: 1,2-DIOCTANOYL-SN-GLYCERO-3-PHOSPHATE, Calcium homeostasis modulator protein 5
著者Liu, J, Guan, F.H, Wu, J, Wan, F.T, Lei, M, Ye, S.
登録日2020-09-28
公開日2020-12-23
最終更新日2024-10-16
実験手法ELECTRON MICROSCOPY (2.61 Å)
主引用文献Cryo-EM structures of human calcium homeostasis modulator 5.
Cell Discov, 6, 2020
7X45
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BU of 7x45 by Molmil
Grass carp interferon gamma related
分子名称: Interferon gamma
著者Wang, J, Zou, J, Zhu, X.
登録日2022-03-02
公開日2022-09-14
最終更新日2024-10-09
実験手法X-RAY DIFFRACTION (2.26 Å)
主引用文献Novel Dimeric Architecture of an IFN-gamma-Related Cytokine Provides Insights into Subfunctionalization of Type II IFNs in Teleost Fish.
J Immunol., 209, 2022
7D65
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BU of 7d65 by Molmil
Cryo-EM Structure of human CALHM5 in the presence of Ca2+
分子名称: 1,2-DIOCTANOYL-SN-GLYCERO-3-PHOSPHATE, Calcium homeostasis modulator protein 5
著者Liu, J, Guan, F.H, Wu, J, Wan, F.T, Lei, M, Ye, S.
登録日2020-09-29
公開日2020-12-23
最終更新日2024-11-20
実験手法ELECTRON MICROSCOPY (2.94 Å)
主引用文献Cryo-EM structures of human calcium homeostasis modulator 5.
Cell Discov, 6, 2020
7D61
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BU of 7d61 by Molmil
Cryo-EM Structure of human CALHM5 in the presence of EDTA
分子名称: 1,2-DIOCTANOYL-SN-GLYCERO-3-PHOSPHATE, Calcium homeostasis modulator protein 5
著者Liu, J, Guan, F.H, Wu, J, Wan, F.T, Lei, M, Ye, S.
登録日2020-09-28
公開日2020-12-23
最終更新日2024-10-23
実験手法ELECTRON MICROSCOPY (2.8 Å)
主引用文献Cryo-EM structures of human calcium homeostasis modulator 5.
Cell Discov, 6, 2020
8ZF0
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BU of 8zf0 by Molmil
pRib-ADP bound OsEDS1-PAD4-ADR1 complex
分子名称: EDS1, Lipase-like PAD4, RPW8 domain-containing protein, ...
著者Xu, W.Y, Zhang, Y.
登録日2024-05-07
公開日2024-11-13
最終更新日2025-01-01
実験手法ELECTRON MICROSCOPY (2.96 Å)
主引用文献A canonical protein complex controls immune homeostasis and multipathogen resistance.
Science, 386, 2024
7WY4
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BU of 7wy4 by Molmil
Structure of the CYP102A1 F87A Haem Domain with N-Enanthyl-L-Prolyl-L-Phenylalanine in complex with Styrene
分子名称: (2S)-2-[[(2S)-1-heptylpyrrolidin-2-yl]carbonylamino]-3-phenyl-propanoic acid, Bifunctional cytochrome P450/NADPH--P450 reductase, CHLORIDE ION, ...
著者Suzuki, K, Stanfield, J.K, Shisaka, Y, Omura, K, Kasai, C, Sugimoto, H, Shoji, O.
登録日2022-02-15
公開日2023-01-04
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.45 Å)
主引用文献A Compound I Mimic Reveals the Transient Active Species of a Cytochrome P450 Enzyme: Insight into the Stereoselectivity of P450-Catalysed Oxidations.
Angew.Chem.Int.Ed.Engl., 62, 2023
7WY1
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BU of 7wy1 by Molmil
Structure of the Oxomolybdenum Mesoporphyrin IX-Reconstituted CYP102A1 Haem Domain with N-Enanthyl-L-Prolyl-L-Phenylalanine in complex with Styerene
分子名称: (2S)-2-[[(2S)-1-heptylpyrrolidin-2-yl]carbonylamino]-3-phenyl-propanoic acid, Bifunctional cytochrome P450/NADPH--P450 reductase, Oxomolybdenum Mesoporphyrin IX, ...
著者Suzuki, K, Stanfield, J.K, Shisaka, Y, Omura, K, Kasai, C, Sugimoto, H, Shoji, O.
登録日2022-02-15
公開日2023-01-04
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献A Compound I Mimic Reveals the Transient Active Species of a Cytochrome P450 Enzyme: Insight into the Stereoselectivity of P450-Catalysed Oxidations.
Angew.Chem.Int.Ed.Engl., 62, 2023

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件を2025-07-09に公開中

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