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4UIZ
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BU of 4uiz by Molmil
N-TERMINAL BROMODOMAIN OF HUMAN BRD4 WITH 7-(3,4-dimethoxyphenyl)-2-(4-methanesulfonylpiperazine-1-carbonyl)-5-methyl-4H,5H-thieno-3,2-c- pyridin-4-one
分子名称: 1,2-ETHANEDIOL, 7-(3,4-dimethoxyphenyl)-5-methyl-2-(4-methylsulfonylpiperazin-1-yl)carbonyl-thieno[3,2-c]pyridin-4-one, BROMODOMAIN-CONTAINING PROTEIN 4
著者Chung, C, Theodoulou, N.T, Bamborough, P, Humphreys, P.G.
登録日2015-04-03
公開日2015-04-22
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.19 Å)
主引用文献The Discovery of I-Brd9, a Selective Cell Active Chemical Probe for Bromodomain Containing Protein 9 Inhibition.
J.Med.Chem., 59, 2016
4V3D
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BU of 4v3d by Molmil
The CIDRa domain from HB3var03 PfEMP1 bound to endothelial protein C receptor
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ENDOTHELIAL PROTEIN C RECEPTOR, ...
著者Lau, C.K.Y, Turner, L, Jespersen, J.S, Lowe, E.D, Petersen, B, Wang, C.W, Petersen, J.E.V, Lusingu, J, Theander, T.G, Lavstsen, T, Higgins, M.K.
登録日2014-10-17
公開日2014-12-17
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (2.65 Å)
主引用文献Structural Conservation Despite Huge Sequence Diversity Allows Epcr Binding by the Pfemp1 Family Implicated in Severe Childhood Malaria.
Cell Host Microbe., 17, 2015
4UIX
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BU of 4uix by Molmil
N-TERMINAL BROMODOMAIN OF HUMAN BRD4 WITH 7-(3,4-dimethoxyphenyl)-N-(1,1-dioxo-1-thian-4-yl)-5-methyl-4-oxo-4H,5H-thieno-3,2-c-pyridine-2- carboxamide
分子名称: 1,2-ETHANEDIOL, BROMODOMAIN-CONTAINING PROTEIN 4, CALCIUM ION, ...
著者Chung, C, Theodoulou, N.T, Bamborough, P, Humphreys, P.G.
登録日2015-04-03
公開日2015-04-22
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.58 Å)
主引用文献The Discovery of I-Brd9, a Selective Cell Active Chemical Probe for Bromodomain Containing Protein 9 Inhibition.
J.Med.Chem., 59, 2016
9VG5
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BU of 9vg5 by Molmil
NMR Solution Structure of the Monomeric Catalytic C-terminal Lobe of the E6AP HECT E3 Ubiquitin Ligase
分子名称: Ubiquitin-protein ligase E3A
著者Dag, C, Lambert, M, Lohr, F, Lee, W, Kazar, A.E, Dotsch, V.
登録日2025-06-12
公開日2025-06-25
実験手法SOLUTION NMR
主引用文献NMR Solution Structure of the Monomeric Catalytic C-terminal Lobe of the E6AP HECT E3 Ubiquitin Ligase
To Be Published
5YMR
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BU of 5ymr by Molmil
The Crystal Structure of IseG
分子名称: 2-hydroxyethylsulfonic acid, Formate acetyltransferase, GLYCEROL
著者Lin, L, Zhang, J, Xing, M, Hua, G, Guo, C, Hu, Y, Wei, Y, Ang, E, Zhao, H, Zhang, Y, Yuchi, Z.
登録日2017-10-22
公開日2019-03-20
最終更新日2024-03-27
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Radical-mediated C-S bond cleavage in C2 sulfonate degradation by anaerobic bacteria.
Nat Commun, 10, 2019
9KDP
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BU of 9kdp by Molmil
Crystal structure of monooxygenase PenE
分子名称: Anthrone monooxygenase
著者Chi, C.B, Ma, M.
登録日2024-11-03
公開日2025-07-09
実験手法X-RAY DIFFRACTION (2.592 Å)
主引用文献Functional Conservation and Divergence of AlpJ-Family Oxygenases Catalyzing C-C Bond Cleavage in Atypical Angucycline Biosynthesis.
Acs Chem.Biol., 2025
7OKW
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BU of 7okw by Molmil
1.62A X-ray crystal structure of the conserved C-terminal (CCT) of human OSR1
分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, CALCIUM ION, MAGNESIUM ION, ...
著者Bax, B.D, Elvers, K.T, Lipka-Lloyd, M, Mehellou, Y.
登録日2021-05-18
公開日2021-09-22
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.62 Å)
主引用文献Structures of the Human SPAK and OSR1 Conserved C-Terminal (CCT) Domains.
Chembiochem, 23, 2022
7OKU
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X-ray structure of soluble EPCR in P3121 space group
分子名称: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
著者Erausquin, E, Dichiara, M.G, Lopez-Sagaseta, J.
登録日2021-05-18
公開日2022-06-22
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Identification of a broad lipid repertoire associated to the endothelial cell protein C receptor (EPCR).
Sci Rep, 12, 2022
7OKV
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Crystal structure of soluble EPCR after exposure to the nonionic surfactant Polysorbate 20
分子名称: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, DECANE, ...
著者Erausquin, E, Dichiara, M.G, Lopez-Sagaseta, J.
登録日2021-05-18
公開日2022-07-06
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Identification of a broad lipid repertoire associated to the endothelial cell protein C receptor (EPCR).
Sci Rep, 12, 2022
9R5Y
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BU of 9r5y by Molmil
Crystal structure of the C-terminal domain of human TNC in complex with Adhiron 52
分子名称: Adhiron, Tenascin
著者Gaule, T.G, Trinh, C, Simmons, K.J, Tomlinson, D.C, Maqbool, A.
登録日2025-05-11
公開日2025-06-18
実験手法X-RAY DIFFRACTION (1.399 Å)
主引用文献Targeting Tenascin-C-Toll-like Receptor 4 signalling with Adhiron-derived small molecules - a viable strategy for reducing fibrosis in Systemic Sclerosis
To Be Published
9KQP
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PSI-LHCI supercomplex binding with 10 Lhcas from C. subellipsoidea
分子名称: (3R,3'R,6S)-4,5-DIDEHYDRO-5,6-DIHYDRO-BETA,BETA-CAROTENE-3,3'-DIOL, (3S,5R,6S,3'S,5'R,6'S)-5,6,5',6'-DIEPOXY-5,6,5',6'- TETRAHYDRO-BETA,BETA-CAROTENE-3,3'-DIOL, (3~{E},5~{E},7~{E})-6-methyl-8-[(6~{R})-2,2,6-trimethylcyclohexyl]octa-3,5,7-trien-2-one, ...
著者Tsai, P.-C, Kato, K, Shen, J.-R, Akita, F.
登録日2024-11-26
公開日2025-02-26
実験手法ELECTRON MICROSCOPY (1.92 Å)
主引用文献Structural study of the chlorophyll between Lhca8 and PsaJ in an Antarctica green algal photosystem I-LHCI supercomplex revealed by its atomic structure.
Biochim Biophys Acta Bioenerg, 1866, 2025
9KQQ
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PSI-LHCI supercomplex binding with 8 Lhcas from C. subellipsoidea
分子名称: (3R,3'R,6S)-4,5-DIDEHYDRO-5,6-DIHYDRO-BETA,BETA-CAROTENE-3,3'-DIOL, (3S,5R,6S,3'S,5'R,6'S)-5,6,5',6'-DIEPOXY-5,6,5',6'- TETRAHYDRO-BETA,BETA-CAROTENE-3,3'-DIOL, 1,2-DI-O-ACYL-3-O-[6-DEOXY-6-SULFO-ALPHA-D-GLUCOPYRANOSYL]-SN-GLYCEROL, ...
著者Tsai, P.-C, Kato, K, Shen, J.-R, Akita, F.
登録日2024-11-26
公開日2025-02-26
実験手法ELECTRON MICROSCOPY (2.06 Å)
主引用文献Structural study of the chlorophyll between Lhca8 and PsaJ in an Antarctica green algal photosystem I-LHCI supercomplex revealed by its atomic structure.
Biochim Biophys Acta Bioenerg, 1866, 2025
7RIC
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BU of 7ric by Molmil
Griffithsin variant Y28W/Y68W/Y110W
分子名称: Griffithsin
著者Zhao, G, Sun, J, Bewley, C.A.
登録日2021-07-19
公開日2022-05-18
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献C 3 -Symmetric Aromatic Core of Griffithsin Is Essential for Potent Anti-HIV Activity.
Acs Chem.Biol., 17, 2022
7RID
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BU of 7rid by Molmil
Griffithsin variant Y28A
分子名称: Griffithsin
著者Zhao, G, Sun, J, Bewley, C.A.
登録日2021-07-19
公開日2022-05-18
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献C 3 -Symmetric Aromatic Core of Griffithsin Is Essential for Potent Anti-HIV Activity.
Acs Chem.Biol., 17, 2022
8VS5
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BU of 8vs5 by Molmil
Structure of catalytic domain of telomere resolvase, ResT, from Borrelia garinii
分子名称: Telomere resolvase ResT
著者Semper, C, Savchenko, A, Watanabe, N, Center for Structural Biology of Infectious Diseases (CSBID)
登録日2024-01-23
公開日2024-07-17
最終更新日2024-08-28
実験手法X-RAY DIFFRACTION (2.796 Å)
主引用文献Structure analysis of the telomere resolvase from the Lyme disease spirochete Borrelia garinii reveals functional divergence of its C-terminal domain.
Nucleic Acids Res., 52, 2024
9MTU
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BU of 9mtu by Molmil
Crystal structure of apo-ADC-1 beta-lactamase
分子名称: Beta-lactamase
著者Smith, C.A, Stewart, N.K, Vakulenko, S.B.
登録日2025-01-12
公開日2025-04-23
最終更新日2025-06-18
実験手法X-RAY DIFFRACTION (1.3 Å)
主引用文献Evolution of carbapenemase activity in the class C beta-lactamase ADC-1.
Mbio, 16, 2025
1CYI
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BU of 1cyi by Molmil
CYTOCHROME C6
分子名称: CADMIUM ION, CYTOCHROME C6, HEME C
著者Kerfeld, C.A, Yeates, T.O.
登録日1995-05-09
公開日1996-01-29
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献The structure of chloroplast cytochrome c6 at 1.9 A resolution: evidence for functional oligomerization.
J.Mol.Biol., 250, 1995
9MTV
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BU of 9mtv by Molmil
Crystal structure of an apo-ADC-1 triple mutant
分子名称: 1,2-ETHANEDIOL, Beta-lactamase, NITRATE ION
著者Smith, C.A, Stewart, N.K, Vakulenko, S.B.
登録日2025-01-12
公開日2025-04-23
最終更新日2025-06-18
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Evolution of carbapenemase activity in the class C beta-lactamase ADC-1.
Mbio, 16, 2025
9MTW
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Crystal structure of ADC-1-ertapenem complex
分子名称: (2S,3R,4R)-4-({(3S,5S)-5-[(3-carboxyphenyl)carbamoyl]pyrrolidin-3-yl}sulfanyl)-2-[(2S,3R)-3-hydroxy-1-oxobutan-2-yl]-3-methyl-3,4-dihydro-2H-pyrrole-5-carboxylic acid, (4R,5S)-3-({(3S,5S)-5-[(3-carboxyphenyl)carbamoyl]pyrrolidin-3-yl}sulfanyl)-5-[(1S,2R)-1-formyl-2-hydroxypropyl]-4-methyl-4,5-dihydro-1H-pyrrole-2-carboxylic acid, 1,2-ETHANEDIOL, ...
著者Smith, C.A, Stewart, N.K, Vakulenko, S.B.
登録日2025-01-12
公開日2025-04-23
最終更新日2025-06-18
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Evolution of carbapenemase activity in the class C beta-lactamase ADC-1.
Mbio, 16, 2025
8GCI
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BU of 8gci by Molmil
Crystal structure of C. elegans LIN-42 PAS-B domain
分子名称: Period protein homolog lin-42
著者Spangler, B.K, Coronado, A.R, Tripathi, S.M, Ward, J.D, Partch, C.L.
登録日2023-03-01
公開日2023-03-15
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (2.42 Å)
主引用文献Crystal structure of C. elegans LIN-42 PAS-B domain
To Be Published
6NL3
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Solution structure of human Coa6
分子名称: Cytochrome c oxidase assembly factor 6 homolog
著者Naik, M.T, Soma, S, Gohil, V.
登録日2019-01-07
公開日2019-11-20
最終更新日2024-10-16
実験手法SOLUTION NMR
主引用文献COA6 Is Structurally Tuned to Function as a Thiol-Disulfide Oxidoreductase in Copper Delivery to Mitochondrial Cytochrome c Oxidase.
Cell Rep, 29, 2019
1E29
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BU of 1e29 by Molmil
PSII associated cytochrome C549 from Synechocystis sp.
分子名称: CALCIUM ION, CYTOCHROME C549, HEME C
著者Frazao, C, Enguita, F.J, Coelho, R, Sheldrick, G.M.
登録日2000-05-19
公開日2001-05-04
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (1.21 Å)
主引用文献Crystal Structure of Low-Potential Cytochrome C549 from Synechocystis Sp. Pcc 6803 at 1.21A Resolution
J.Biol.Inorg.Chem., 6, 2001
9MXI
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Crystal Structure of synthetic antibody, COP-2, in complex with the C-terminal domain of Clostridium perfringens Enterotoxin
分子名称: COP-2 antibody heavy chain, COP-2 antibody light chain, GLYCEROL, ...
著者Ogbu, C.P, Kapoor, S, Vecchio, A.J.
登録日2025-01-20
公開日2025-02-12
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Crystal Structure of synthetic antibody, COP-2, in complex with the C-terminal domain of Clostridium perfringens Enterotoxin
To Be Published
7OJS
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BU of 7ojs by Molmil
Complex structure 2 of the Bacillus subtilis CdaA c-di-AMP cyclase domain (CdaACD) and the phosphoglucomutase GlmM short variant (GlmMF369)
分子名称: Cyclic di-AMP synthase CdaA, Phosphoglucosamine mutase
著者Pathania, M, Grundling, A.G, Freemont, P.
登録日2021-05-17
公開日2021-10-27
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (4.2 Å)
主引用文献Structural basis for the inhibition of the Bacillus subtilis c-di-AMP cyclase CdaA by the phosphoglucomutase GlmM.
J.Biol.Chem., 297, 2021
8QN0
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BU of 8qn0 by Molmil
Soluble epoxide hydrolase in complex with RK3
分子名称: (3~{a}~{R},6~{a}~{S})-~{N}-[(2,4-dichlorophenyl)methyl]-5-(4-methylphenyl)sulfonyl-1,3,3~{a},4,6,6~{a}-hexahydropyrrolo[3,4-c]pyrrole-2-carboxamide, 1,2-ETHANEDIOL, Bifunctional epoxide hydrolase 2
著者Kumar, A, Zhu, F, Ehrler, J.M.H, Li, F, Empel, C, Xu, Y, Atodiresei, I, Koenigs, R.M, Proschak, E, Knapp, S, Structural Genomics Consortium (SGC)
登録日2023-09-25
公開日2024-02-14
実験手法X-RAY DIFFRACTION (1.49 Å)
主引用文献Photosensitization enables Pauson-Khand-type reactions with nitrenes.
Science, 383, 2024

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件を2025-07-16に公開中

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