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3U4U
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BU of 3u4u by Molmil
Casein kinase 2 in complex with AZ-Inhibitor
分子名称: 3-{5-(acetylamino)-3-[3-cyano-7-(cyclopropylamino)pyrazolo[1,5-a]pyrimidin-5-yl]-1H-indol-1-yl}propanoic acid, CHLORIDE ION, Casein kinase II subunit alpha
著者Larsen, N.A, Dowling, J.
登録日2011-10-10
公開日2012-08-22
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Potent and Selective Inhibitors of CK2 Kinase Identified through Structure-Guided Hybridization.
ACS Med Chem Lett, 3, 2012
7VT2
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BU of 7vt2 by Molmil
Azumapecten Farreri ferritin
分子名称: FE (III) ION, Ferritin
著者Zhao, G, Zhang, C.
登録日2021-10-27
公開日2022-11-16
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Structural comparison between the DNA-protective ability of scallop and shrimp ferritin from iron-induced oxidative damage.
Food Chem, 386, 2022
5WQA
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BU of 5wqa by Molmil
Crystal structure of PDE4D catalytic domain complexed with Selaginpulvilins K
分子名称: 1-[2-(4-hydroxyphenyl)ethynyl]-9,9-bis(4-methoxyphenyl)-7-oxidanyl-fluorene-2-carbaldehyde, MAGNESIUM ION, ZINC ION, ...
著者Huang, Y, Zhang, T, Zheng, X, Yin, S, Luo, H.B.
登録日2016-11-24
公開日2017-02-22
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献The discovery, complex crystal structure, and recognition mechanism of a novel natural PDE4 inhibitor from Selaginella pulvinata
Biochem. Pharmacol., 130, 2017
7WCV
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BU of 7wcv by Molmil
Co-crystal structure of FTO bound to 6e
分子名称: 2-OXOGLUTARIC ACID, 2-[[2,6-bis(chloranyl)-4-pyridin-4-yl-phenyl]amino]benzoic acid, Alpha-ketoglutarate-dependent dioxygenase FTO, ...
著者Yang, C.-G, Gan, J.H.
登録日2021-12-20
公開日2022-07-06
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Structure-Activity Relationships and Antileukemia Effects of the Tricyclic Benzoic Acid FTO Inhibitors.
J.Med.Chem., 65, 2022
7WID
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BU of 7wid by Molmil
Crystal structure of Staphylococcus aureus ClpP in complex with ZG180
分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, (6S,9aS)-6-[(2S)-butan-2-yl]-8-(naphthalen-1-ylmethyl)-4,7-bis(oxidanylidene)-N-[4,4,4-tris(fluoranyl)butyl]-3,6,9,9a-tetrahydro-2H-pyrazino[1,2-a]pyrimidine-1-carboxamide, ATP-dependent Clp protease proteolytic subunit, ...
著者Wei, B.Y, Gan, J.H, Yang, C.-G.
登録日2022-01-03
公開日2022-11-16
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Anti-infective therapy using species-specific activators of Staphylococcus aureus ClpP.
Nat Commun, 13, 2022
7WGS
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BU of 7wgs by Molmil
Structure of ClpP from Staphylococcus aureus in complex with (S)-ZG197
分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, (6S,9aS)-6-[(2R)-butan-2-yl]-8-[(1S)-1-naphthalen-1-ylethyl]-4,7-bis(oxidanylidene)-N-[4,4,4-tris(fluoranyl)butyl]-3,6,9,9a-tetrahydro-2H-pyrazino[1,2-a]pyrimidine-1-carboxamide, ATP-dependent Clp protease proteolytic subunit
著者Yang, C.-G, Gan, J.H.
登録日2021-12-28
公開日2022-11-16
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.11 Å)
主引用文献Anti-infective therapy using species-specific activators of Staphylococcus aureus ClpP.
Nat Commun, 13, 2022
7WH5
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BU of 7wh5 by Molmil
Crystal structure of human ClpP in complex with ZG180
分子名称: (6S,9aS)-6-[(2S)-butan-2-yl]-8-(naphthalen-1-ylmethyl)-4,7-bis(oxidanylidene)-N-[4,4,4-tris(fluoranyl)butyl]-3,6,9,9a-tetrahydro-2H-pyrazino[1,2-a]pyrimidine-1-carboxamide, ATP-dependent Clp protease proteolytic subunit, mitochondrial, ...
著者Wei, B.Y, Gan, J.H, Yang, C.-G.
登録日2021-12-29
公開日2022-11-16
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.13 Å)
主引用文献Anti-infective therapy using species-specific activators of Staphylococcus aureus ClpP.
Nat Commun, 13, 2022
7X77
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BU of 7x77 by Molmil
Ectodomain structure of per os infectivity factor 5
分子名称: Per os infectivity factor 5
著者Cao, S, Li, Z, Fu, Y.
登録日2022-03-09
公開日2022-06-22
最終更新日2024-10-09
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Structural Characterization of Per Os Infectivity Factor 5 (PIF5) Reveals the Essential Role of Intramolecular Interactions in Baculoviral Oral Infectivity.
J.Virol., 96, 2022
7XBZ
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BU of 7xbz by Molmil
Crystal structure of Staphylococcus aureus ClpP in complex with R-ZG197
分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, (6S,9aS)-6-[(2S)-butan-2-yl]-8-[(1R)-1-naphthalen-1-ylethyl]-4,7-bis(oxidanylidene)-N-[4,4,4-tris(fluoranyl)butyl]-3,6,9,9a-tetrahydro-2H-pyrazino[1,2-a]pyrimidine-1-carboxamide, ATP-dependent Clp protease proteolytic subunit, ...
著者Wei, B.Y, Gan, J.H, Yang, C.-G.
登録日2022-03-22
公開日2022-11-16
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.15 Å)
主引用文献Anti-infective therapy using species-specific activators of Staphylococcus aureus ClpP.
Nat Commun, 13, 2022
7DFT
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BU of 7dft by Molmil
Crystal structure of Xanthomonas oryzae ClpP
分子名称: ATP-dependent Clp protease proteolytic subunit, CHLORIDE ION
著者Yang, C.-G, Yang, T.
登録日2020-11-09
公開日2021-05-19
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Dysregulation of ClpP by Small-Molecule Activators Used Against Xanthomonas oryzae pv. oryzae Infections.
J.Agric.Food Chem., 69, 2021
7DFU
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BU of 7dfu by Molmil
Crystal structure of Xanthomonas oryzae ClpP S68Y in complex with ADEP4.
分子名称: ATP-dependent Clp protease proteolytic subunit, CHLORIDE ION, MAGNESIUM ION, ...
著者Yang, C.-G, Yang, T.
登録日2020-11-09
公開日2021-05-19
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.901 Å)
主引用文献Dysregulation of ClpP by Small-Molecule Activators Used Against Xanthomonas oryzae pv. oryzae Infections.
J.Agric.Food Chem., 69, 2021
8J0H
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BU of 8j0h by Molmil
Crystal structure of the fission yeast Rex1BD protein(C4H3.06)
分子名称: Uncharacterized protein C4H3.06
著者Li, J, Sun, W, Chen, Y.
登録日2023-04-11
公開日2023-11-01
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (3.383 Å)
主引用文献Rex1BD and the 14-3-3 protein control heterochromatin organization at tandem repeats by linking RNAi and HDAC.
Proc.Natl.Acad.Sci.USA, 120, 2023
8IYA
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BU of 8iya by Molmil
Complex of SETDB1-derived peptide bound to UBE2E1
分子名称: Histone-lysine N-methyltransferase SETDB1, SULFATE ION, Ubiquitin-conjugating enzyme E2 E1
著者Du, Y.X, Liu, L.
登録日2023-04-04
公開日2024-01-03
最終更新日2024-07-17
実験手法X-RAY DIFFRACTION (2.43 Å)
主引用文献Structure-guided engineering enables E3 ligase-free and versatile protein ubiquitination via UBE2E1.
Nat Commun, 15, 2024
8J9M
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BU of 8j9m by Molmil
Crystal Structure of Human H-Ferritin variant 123F assembling in solution3
分子名称: FE (III) ION, Ferritin heavy chain
著者Chen, X, Zhao, G.
登録日2023-05-04
公開日2024-01-31
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献Shape-Anisotropic Assembly of Protein Nanocages with Identical Building Blocks by Designed Intermolecular pi-pi Interactions.
Adv Sci, 10, 2023
8J9L
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BU of 8j9l by Molmil
Crystal Structure of Human H-Ferritin variant 123F assembling in solution2
分子名称: FE (III) ION, Ferritin heavy chain
著者Chen, X, Zhao, G.
登録日2023-05-04
公開日2024-01-31
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Shape-Anisotropic Assembly of Protein Nanocages with Identical Building Blocks by Designed Intermolecular pi-pi Interactions.
Adv Sci, 10, 2023
8JAI
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BU of 8jai by Molmil
Crystal Structure of Human H-Ferritin variant 123F assembling in solution 1
分子名称: FE (III) ION, Ferritin heavy chain
著者Chen, X, Zhao, G.
登録日2023-05-06
公開日2024-01-31
実験手法X-RAY DIFFRACTION (2.56 Å)
主引用文献Shape-Anisotropic Assembly of Protein Nanocages with Identical Building Blocks by Designed Intermolecular pi-pi Interactions.
Adv Sci, 10, 2023
7F5X
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BU of 7f5x by Molmil
GK domain of Drosophila P5CS filament with glutamate
分子名称: Delta-1-pyrroline-5-carboxylate synthase, GAMMA-L-GLUTAMIC ACID
著者Liu, J.L, Zhong, J, Guo, C.J, Zhou, X.
登録日2021-06-23
公開日2022-04-06
最終更新日2024-06-12
実験手法ELECTRON MICROSCOPY (3.5 Å)
主引用文献Structural basis of dynamic P5CS filaments.
Elife, 11, 2022
7F5V
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BU of 7f5v by Molmil
Drosophila P5CS filament with glutamate, ATP, and NADPH
分子名称: Delta-1-pyrroline-5-carboxylate synthase
著者Liu, J.L, Zhong, J, Guo, C.J, Zhou, X.
登録日2021-06-22
公開日2022-04-06
最終更新日2024-06-12
実験手法ELECTRON MICROSCOPY (3.6 Å)
主引用文献Structural basis of dynamic P5CS filaments.
Elife, 11, 2022
7F5U
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BU of 7f5u by Molmil
Drosophila P5CS filament with glutamate and ATPgammaS
分子名称: Delta-1-pyrroline-5-carboxylate synthase
著者Liu, J.L, Zhong, J, Guo, C.J, Zhou, X.
登録日2021-06-22
公開日2022-04-06
最終更新日2024-06-12
実験手法ELECTRON MICROSCOPY (4.1 Å)
主引用文献Structural basis of dynamic P5CS filaments.
Elife, 11, 2022
7ER2
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BU of 7er2 by Molmil
Crystal structure of EGFR 696-1022 T790M/C797S in complex with LS_2_40
分子名称: 5-chloranyl-N2-[3-chloranyl-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]-N4-(2-dimethylphosphorylphenyl)pyrimidine-2,4-diamine, Epidermal growth factor receptor
著者Zhu, S.J, Yun, C.H.
登録日2021-05-05
公開日2022-04-20
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.662 Å)
主引用文献Optimization of Brigatinib as New Wild-Type Sparing Inhibitors of EGFR T790M/C797S Mutants.
Acs Med.Chem.Lett., 13, 2022
7F5T
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BU of 7f5t by Molmil
Drosophila P5CS filament with glutamate
分子名称: Delta-1-pyrroline-5-carboxylate synthase, GLUTAMIC ACID
著者Liu, J.L, Zhong, J, Guo, C.J, Zhou, X.
登録日2021-06-22
公開日2022-05-18
最終更新日2024-06-12
実験手法ELECTRON MICROSCOPY (4.1 Å)
主引用文献Structural basis of dynamic P5CS filaments.
Elife, 11, 2022
7DWA
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BU of 7dwa by Molmil
Structure of a novel beta-mannanase BaMan113A with mannotriose, N236Y mutation
分子名称: Endo-beta-1,4-mannanase, beta-D-mannopyranose-(1-4)-beta-D-mannopyranose-(1-4)-alpha-D-mannopyranose
著者Liu, W.T, Liu, W.D, Zheng, Y.Y.
登録日2021-01-15
公開日2021-06-02
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.62 Å)
主引用文献Functional and structural investigation of a novel beta-mannanase BaMan113A from Bacillus sp. N16-5.
Int.J.Biol.Macromol., 182, 2021
7DW8
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BU of 7dw8 by Molmil
Structure of a novel beta-mannanase BaMan113A with mannobiose, N236Y mutation.
分子名称: Endo-beta-1,4-mannanase, beta-D-mannopyranose-(1-4)-beta-D-mannopyranose
著者Liu, W.T, Liu, W.D, Zheng, Y.Y.
登録日2021-01-15
公開日2021-06-02
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Functional and structural investigation of a novel beta-mannanase BaMan113A from Bacillus sp. N16-5.
Int.J.Biol.Macromol., 182, 2021
7DVJ
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BU of 7dvj by Molmil
Structure of beta-mannanase BaMan113A with mannobiose
分子名称: Endo-beta-1,4-mannanase, beta-D-mannopyranose-(1-4)-beta-D-mannopyranose
著者Liu, W.T, Liu, W.D, Zheng, Y.Y.
登録日2021-01-13
公開日2021-06-02
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Functional and structural investigation of a novel beta-mannanase BaMan113A from Bacillus sp. N16-5.
Int.J.Biol.Macromol., 182, 2021
7DVZ
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BU of 7dvz by Molmil
Structure of a novel beta-mannanase BaMan113A from Bacillus sp. N16-5, N236Y mutation.
分子名称: Endo-beta-1,4-mannanase
著者Liu, W.T, Liu, W.D, Zheng, Y.Y.
登録日2021-01-15
公開日2021-06-02
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Functional and structural investigation of a novel beta-mannanase BaMan113A from Bacillus sp. N16-5.
Int.J.Biol.Macromol., 182, 2021

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