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PDB: 16 件

7D24
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BU of 7d24 by Molmil
Hsp90 alpha N-terminal domain in complex with a 4B compund
分子名称: 9-[(3-tert-butyl-1,2-oxazol-5-yl)methyl]-6-chloranyl-purin-2-amine, Heat shock protein HSP 90-alpha
著者Shin, S.C, Kim, E.E.
登録日2020-09-15
公開日2021-07-28
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献Structural Basis for Design of New Purine-Based Inhibitors Targeting the Hydrophobic Binding Pocket of Hsp90.
Int J Mol Sci, 21, 2020
7D26
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Hsp90 alpha N-terminal domain in complex with a 8 compund
分子名称: 6-chloranyl-9-[(2-phenyl-1,3-oxazol-5-yl)methyl]purin-2-amine, Heat shock protein HSP 90-alpha
著者Shin, S.C, Kim, E.E.
登録日2020-09-15
公開日2021-07-28
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Structural Basis for Design of New Purine-Based Inhibitors Targeting the Hydrophobic Binding Pocket of Hsp90.
Int J Mol Sci, 21, 2020
7D22
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BU of 7d22 by Molmil
Hsp90 alpha N-terminal domain in complex with a 6B compund
分子名称: 9-[(3-tert-butyl-1,2-oxazol-5-yl)methyl]-6-chloranyl-purin-2-amine, Heat shock protein HSP 90-alpha
著者Shin, S.C, Kim, E.E.
登録日2020-09-15
公開日2021-07-28
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Structural Basis for Design of New Purine-Based Inhibitors Targeting the Hydrophobic Binding Pocket of Hsp90.
Int J Mol Sci, 21, 2020
7D1V
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BU of 7d1v by Molmil
Hsp90 alpha N-terminal domain in complex with a 6C compund
分子名称: 6-chloranyl-9-[(3-propan-2-yl-1,2-oxazol-5-yl)methyl]purin-2-amine, Heat shock protein HSP 90-alpha
著者Shin, S.C, Kim, E.E.
登録日2020-09-15
公開日2021-07-28
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.332 Å)
主引用文献Structural Basis for Design of New Purine-Based Inhibitors Targeting the Hydrophobic Binding Pocket of Hsp90.
Int J Mol Sci, 21, 2020
7D25
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BU of 7d25 by Molmil
Hsp90 alpha N-terminal domain in complex with a 14 compund
分子名称: 6-chloranyl-9-[(4-methylphenyl)methyl]purin-2-amine, Heat shock protein HSP 90-alpha
著者Shin, S.C, Kim, E.E.
登録日2020-09-15
公開日2021-07-28
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Structural Basis for Design of New Purine-Based Inhibitors Targeting the Hydrophobic Binding Pocket of Hsp90.
Int J Mol Sci, 21, 2020
7TBA
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BU of 7tba by Molmil
Pentraxin - ligand complex
分子名称: C-reactive protein, CALCIUM ION, [3-(dibutylamino)propyl]phosphonic acid
著者Shing, K.S.C.T, Morton, C.J, Parker, M.W.
登録日2021-12-21
公開日2022-10-19
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (3.5 Å)
主引用文献A novel phosphocholine-mimetic inhibits a pro-inflammatory conformational change in C-reactive protein.
Embo Mol Med, 15, 2023
8ITN
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BU of 8itn by Molmil
Crystal structure of USP47apo catalytic domain
分子名称: Ubiquitin carboxyl-terminal hydrolase 47, ZINC ION
著者Kim, E.E, Shin, S.C.
登録日2023-03-22
公開日2024-03-27
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Structural and functional characterization of USP47 reveals a hot spot for inhibitor design.
Commun Biol, 6, 2023
8ITP
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Crystal structure of USP47 catalytic domain complex with ubiquitin
分子名称: Ubiquitin, Ubiquitin carboxyl-terminal hydrolase 47, ZINC ION
著者Kim, E.E, Shin, S.C.
登録日2023-03-22
公開日2024-03-27
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献Structural and functional characterization of USP47 reveals a hot spot for inhibitor design.
Commun Biol, 6, 2023
7FGN
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BU of 7fgn by Molmil
The crystal structure of the FAF1 UBL1
分子名称: FAS-associated factor 1
著者Kim, E.E, ParK, J.K, Shin, S.C.
登録日2021-07-27
公開日2022-07-27
最終更新日2024-05-29
実験手法X-RAY DIFFRACTION (1.199 Å)
主引用文献The complex of Fas-associated factor 1 with Hsp70 stabilizes the adherens junction integrity by suppressing RhoA activation
J Mol Cell Biol, 14, 2022
7FGM
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The complex crystals structure of the FAF1 UBL1_L-Hsp70 NBD with ADP and phosphate
分子名称: ADENOSINE-5'-DIPHOSPHATE, FAS-associated factor 1, Heat shock 70 kDa protein 1A, ...
著者Kim, E.E, ParK, J.K, Shin, S.C.
登録日2021-07-27
公開日2022-07-27
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献The complex of Fas-associated factor 1 with Hsp70 stabilizes the adherens junction integrity by suppressing RhoA activation
J Mol Cell Biol, 14, 2022
5GVJ
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BU of 5gvj by Molmil
Structure of FabK (M276A) mutant from Thermotoga maritima
分子名称: Enoyl-[acyl-carrier-protein] reductase [FMN], SODIUM ION
著者Kim, E.E, Shin, S.C, Ha, B.H, Moon, J.H.
登録日2016-09-06
公開日2017-04-26
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Structural and biochemical characterization of FabK from Thermotoga maritima.
Biochem. Biophys. Res. Commun., 482, 2017
5GVH
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BU of 5gvh by Molmil
Structure of FabK from Thermotoga maritima
分子名称: Enoyl-[acyl-carrier-protein] reductase [FMN], FLAVIN MONONUCLEOTIDE, SODIUM ION
著者Kim, E.E, Shin, S.C, Ha, B.H, Moon, J.H.
登録日2016-09-05
公開日2017-06-07
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (2.294 Å)
主引用文献Structural and biochemical characterization of FabK from Thermotoga maritima.
Biochem. Biophys. Res. Commun., 482, 2017
5H22
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BU of 5h22 by Molmil
Hsp90 alpha N-terminal domain in complex with an inhibitor
分子名称: 4-chloranyl-7-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methyl]-5-(phenylmethyl)pyrrolo[2,3-d]pyrimidin-2-amine, Hsp90aa1 protein
著者Kim, E.E, Shin, S.C, Keum, G.C.
登録日2016-10-13
公開日2017-10-11
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.499 Å)
主引用文献Synthesis and in vitro antiproliferative activity of C5-benzyl substituted 2-amino-pyrrolo[2,3-d]pyrimidines as potent Hsp90 inhibitors.
Bioorg. Med. Chem. Lett., 27, 2017
5X3S
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BU of 5x3s by Molmil
Crystal structure of mouse Plk1-PBD in complex with phosphopeptide from HEF1 (799-809)
分子名称: Peptide from Enhancer of filamentation 1, Serine/threonine-protein kinase PLK1
著者Kim, J.H, Shin, S.C, Kim, E.E.
登録日2017-02-07
公開日2017-12-20
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.899 Å)
主引用文献Phosphorylation of human enhancer filamentation 1 (HEF1) stimulates interaction with Polo-like kinase 1 leading to HEF1 localization to focal adhesions.
J. Biol. Chem., 293, 2018
5ZQM
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BU of 5zqm by Molmil
Crystal structure of human katanin AAA ATPase domain complex with ATPgammaS
分子名称: Katanin p60 ATPase-containing subunit A1, PHOSPHOTHIOPHOSPHORIC ACID-ADENYLATE ESTER
著者Kim, E.E, Shin, S.C.
登録日2018-04-19
公開日2019-02-27
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献Structural and Molecular Basis for Katanin-Mediated Severing of Glutamylated Microtubules.
Cell Rep, 26, 2019
5ZQL
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BU of 5zql by Molmil
crystal structure of human katanin AAA ATPase domain
分子名称: Katanin p60 ATPase-containing subunit A1
著者Kim, E.E, Shin, S.C.
登録日2018-04-19
公開日2019-02-27
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (3.007 Å)
主引用文献Structural and Molecular Basis for Katanin-Mediated Severing of Glutamylated Microtubules.
Cell Rep, 26, 2019

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件を2024-07-31に公開中

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