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7X73
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BU of 7x73 by Molmil
Structure of G9a in complex with RK-701
Descriptor: 1,2-ETHANEDIOL, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Histone-lysine N-methyltransferase EHMT2, ...
Authors:Niwa, H, Shirai, F, Sato, S, Nishigaya, Y, Shirouzu, M, Umehara, T.
Deposit date:2022-03-09
Release date:2022-12-21
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.49 Å)
Cite:A specific G9a inhibitor unveils BGLT3 lncRNA as a universal mediator of chemically induced fetal globin gene expression.
Nat Commun, 14, 2023
2DO6
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BU of 2do6 by Molmil
Solution structure of RSGI RUH-065, a UBA domain from human cDNA
Descriptor: E3 ubiquitin-protein ligase CBL-B
Authors:Hamada, T, Hirota, H, Lin, Y.-J, Guntert, P, Sato, M, Koshiba, S, Kigawa, T, Yokoyama, S, RIKEN Structural Genomics/Proteomics Initiative (RSGI)
Deposit date:2006-04-27
Release date:2007-05-08
Last modified:2024-05-29
Method:SOLUTION NMR
Cite:Solution structure of RSGI RUH-065, a UBA domain from human cDNA
To be Published
9KLB
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BU of 9klb by Molmil
G9a in complex with RK-133232 (compound 16g)
Descriptor: Histone-lysine N-methyltransferase EHMT2, SINEFUNGIN, ZINC ION, ...
Authors:Niwa, H, Shirai, F, Sato, S, Nishigaya, Y, Ihara, K, Shirouzu, M, Umehara, T.
Deposit date:2024-11-14
Release date:2025-05-21
Last modified:2025-06-04
Method:X-RAY DIFFRACTION (1.81 Å)
Cite:Discovery of potent substrate-type lysine methyltransferase G9a inhibitors for the treatment of sickle cell disease.
Eur.J.Med.Chem., 293, 2025
9KLC
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BU of 9klc by Molmil
G9a in complex with the S-isomer of RK-131902 (racemic compound rac-10a)
Descriptor: Histone-lysine N-methyltransferase EHMT2, SINEFUNGIN, ZINC ION, ...
Authors:Niwa, H, Shirai, F, Sato, S, Nishigaya, Y, Ihara, K, Shirouzu, M, Umehara, T.
Deposit date:2024-11-14
Release date:2025-05-21
Last modified:2025-06-04
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:Discovery of potent substrate-type lysine methyltransferase G9a inhibitors for the treatment of sickle cell disease.
Eur.J.Med.Chem., 293, 2025
5AVL
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BU of 5avl by Molmil
Crystal structure of LXRalpha in complex with tert-butyl benzoate analog, compound 32b
Descriptor: 2-[4-[4-[[2-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxidanyl-4-(trifluoromethyl)phenyl]methoxy]phenyl]phenyl]ethanoic acid, Nuclear receptor coactivator 1, Oxysterols receptor LXR-alpha
Authors:Matsui, Y, Hanzawa, H, Tamaki, K.
Deposit date:2015-06-17
Release date:2015-08-26
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Discovery and structure-guided optimization of tert-butyl 6-(phenoxymethyl)-3-(trifluoromethyl)benzoates as liver X receptor agonists
Bioorg.Med.Chem.Lett., 25, 2015
5AVI
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BU of 5avi by Molmil
Crystal structure of LXRalpha in complex with tert-butyl benzoate analog, compound 4
Descriptor: Nuclear receptor coactivator 1, Oxysterols receptor LXR-alpha, tert-butyl 2-[[4-[ethanoyl(methyl)amino]phenoxy]methyl]-5-(trifluoromethyl)benzoate
Authors:Matsui, Y, Hanzawa, H, Tamaki, K.
Deposit date:2015-06-16
Release date:2015-08-26
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Discovery and structure-guided optimization of tert-butyl 6-(phenoxymethyl)-3-(trifluoromethyl)benzoates as liver X receptor agonists
Bioorg.Med.Chem.Lett., 25, 2015
1E79
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BU of 1e79 by Molmil
Bovine F1-ATPase inhibited by DCCD (dicyclohexylcarbodiimide)
Descriptor: ADENOSINE-5'-DIPHOSPHATE, ADENOSINE-5'-TRIPHOSPHATE, ATP SYNTHASE ALPHA CHAIN HEART ISOFORM, ...
Authors:Gibbons, C, Montgomery, M.G, Leslie, A.G.W, Walker, J.E.
Deposit date:2000-08-25
Release date:2000-11-03
Last modified:2024-10-09
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:The Structure of the Central Stalk in Bovine F(1)-ATPase at 2.4 A Resolution.
Nat.Struct.Biol., 7, 2000
2DVX
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BU of 2dvx by Molmil
Crystal Structure of 2,6-Dihydroxybenzoate Decarboxylase Complexed with inhibitor 2,3-dihydroxybenzaldehyde
Descriptor: 2,3-DIHYDROXYBENZALDEHYDE, Thermophilic reversible gamma-resorcylate decarboxylase, ZINC ION
Authors:Goto, M.
Deposit date:2006-08-01
Release date:2006-09-19
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Crystal Structures of Nonoxidative Zn-Dependent 2,6-Dihydroxybenzoate (gamma-Resorcylate) Decarboxylase from Rhizobium sp. Strain MTP-10005
To be Published
2DVT
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BU of 2dvt by Molmil
Crystal Structure of 2,6-Dihydroxybenzoate Decarboxylase from Rhizobium
Descriptor: Thermophilic reversible gamma-resorcylate decarboxylase, ZINC ION
Authors:Goto, M.
Deposit date:2006-08-01
Release date:2006-09-19
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Crystal Structures of Nonoxidative Zn-Dependent 2,6-Dihydroxybenzoate (gamma-Resorcylate) Decarboxylase from Rhizobium sp. Strain MTP-10005
To be Published
7CP0
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BU of 7cp0 by Molmil
Crystal Structure of double mutant Y115E Y117E human Secretory Glutaminyl Cyclase
Descriptor: 1,2-ETHANEDIOL, Glutaminyl-peptide cyclotransferase, SULFATE ION, ...
Authors:Dileep, K.V, Ihara, K, Sakai, N, Shirozu, M, Zhang, K.Y.J.
Deposit date:2020-08-05
Release date:2021-01-13
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Piperidine-4-carboxamide as a new scaffold for designing secretory glutaminyl cyclase inhibitors.
Int.J.Biol.Macromol., 170, 2020
7COZ
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BU of 7coz by Molmil
Crystal Structure of double mutant Y115E Y117E human Secretory Glutaminyl Cyclase in complex with LSB-41
Descriptor: 1,2-ETHANEDIOL, 1-[3-(2-methyl-4-thiophen-2-yl-1,3-thiazol-5-yl)propanoyl]piperidine-4-carboxamide, Glutaminyl-peptide cyclotransferase, ...
Authors:Dileep, K.V, Ihara, K, Sakai, N, Shirozu, M, Zhang, K.Y.J.
Deposit date:2020-08-05
Release date:2021-01-13
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Piperidine-4-carboxamide as a new scaffold for designing secretory glutaminyl cyclase inhibitors.
Int.J.Biol.Macromol., 170, 2020
1IVZ
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BU of 1ivz by Molmil
Solution structure of the SEA domain from murine hypothetical protein homologous to human mucin 16
Descriptor: hypothetical protein 1110008I14RIK
Authors:Maeda, T, Inoue, M, Kigawa, T, Yokoyama, S, RIKEN Structural Genomics/Proteomics Initiative (RSGI)
Deposit date:2002-04-02
Release date:2002-10-02
Last modified:2023-12-27
Method:SOLUTION NMR
Cite:Solution structure of the SEA domain from the murine homologue of ovarian cancer antigen CA125 (MUC16)
J.Biol.Chem., 279, 2004
2DVU
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BU of 2dvu by Molmil
Crystal Structure of 2,6-Dihydroxybenzoate Decarboxylase Complexed with 2,6-Dihydroxybenzoate
Descriptor: 2,6-DIHYDROXYBENZOIC ACID, Thermophilic reversible gamma-resorcylate decarboxylase, ZINC ION
Authors:Goto, M.
Deposit date:2006-08-01
Release date:2006-09-19
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Crystal Structures of Nonoxidative Zn-Dependent 2,6-Dihydroxybenzoate (gamma-Resorcylate) Decarboxylase from Rhizobium sp. Strain MTP-10005
To be Published
7BOT
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BU of 7bot by Molmil
Human SIRT2 in complex with myristoyl thiourea inhibitor, No.23
Descriptor: N-dodecylmethanethioamide, NAD-dependent protein deacetylase sirtuin-2, ZINC ION, ...
Authors:Kudo, N, Olsen, C.A, Minoru, Y.
Deposit date:2020-03-19
Release date:2021-03-24
Last modified:2023-11-29
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Mechanism-based inhibitors of SIRT2: structure-activity relationship, X-ray structures, target engagement, regulation of alpha-tubulin acetylation and inhibition of breast cancer cell migration.
Rsc Chem Biol, 2, 2021
7BOS
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BU of 7bos by Molmil
Human SIRT2 in complex with myristoyl thiourea inhibitor, No.13
Descriptor: Myristoyl thiourea inhibitor, No.13, N-dodecylmethanethioamide, ...
Authors:Kudo, N, Olsen, C.A, Minoru, Y.
Deposit date:2020-03-19
Release date:2021-03-24
Last modified:2024-11-13
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Mechanism-based inhibitors of SIRT2: structure-activity relationship, X-ray structures, target engagement, regulation of alpha-tubulin acetylation and inhibition of breast cancer cell migration.
Rsc Chem Biol, 2, 2021
1BHI
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BU of 1bhi by Molmil
STRUCTURE OF TRANSACTIVATION DOMAIN OF CRE-BP1/ATF-2, NMR, 20 STRUCTURES
Descriptor: CRE-BP1
Authors:Nagadoi, A, Nakazawa, K, Uda, H, Maekawa, T, Ishii, S, Nishimura, Y.
Deposit date:1998-06-09
Release date:1999-06-15
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:Solution structure of the transactivation domain of ATF-2 comprising a zinc finger-like subdomain and a flexible subdomain.
J.Mol.Biol., 287, 1999
1UKX
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BU of 1ukx by Molmil
Solution structure of the RWD domain of mouse GCN2
Descriptor: GCN2 eIF2alpha kinase
Authors:Nameki, N, Yoneyama, M, Koshiba, S, Inoue, M, Kigawa, T, Yokoyama, S, RIKEN Structural Genomics/Proteomics Initiative (RSGI)
Deposit date:2003-09-03
Release date:2004-08-03
Last modified:2023-12-27
Method:SOLUTION NMR
Cite:Solution structure of the RWD domain of the mouse GCN2 protein.
Protein Sci., 13, 2004
9K7O
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BU of 9k7o by Molmil
Coprinopsis cinerea GH131 protein CcGH131B
Descriptor: DI(HYDROXYETHYL)ETHER, Glycoside hydrolase 131 catalytic N-terminal domain-containing protein
Authors:Shiojima, Y, Tonozuka, T.
Deposit date:2024-10-24
Release date:2024-11-06
Last modified:2025-06-25
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Crystal Structure of CcGH131B, a Protein Belonging to Glycoside Hydrolase Family 131 from the Basidiomycete Coprinopsis cinerea .
J Appl Glycosci (1999), 72, 2025
9K7M
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BU of 9k7m by Molmil
Coprinopsis cinerea GH131 protein CcGH131B E161A in complex with cellobiose
Descriptor: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, DI(HYDROXYETHYL)ETHER, Glycoside hydrolase 131 catalytic N-terminal domain-containing protein, ...
Authors:Shiojima, Y, Tonozuka, T.
Deposit date:2024-10-24
Release date:2024-11-06
Last modified:2025-06-25
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:Crystal Structure of CcGH131B, a Protein Belonging to Glycoside Hydrolase Family 131 from the Basidiomycete Coprinopsis cinerea .
J Appl Glycosci (1999), 72, 2025
9JB2
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BU of 9jb2 by Molmil
Cryo-EM structure of the type II amyloid-beta 42 fibril containing a D-Asp at positions 7 and 23
Descriptor: Amyloid-beta precursor protein
Authors:Hsiao, L.C, Lee, C.H, Hsu, M.F, Hsu, S.T.
Deposit date:2024-08-26
Release date:2025-03-26
Last modified:2025-04-09
Method:ELECTRON MICROSCOPY (2.9 Å)
Cite:Impacts of D-aspartate on the Aggregation Kinetics and Structural Polymorphism of Amyloid beta Peptide 1-42.
J.Mol.Biol., 437, 2025
9JAZ
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BU of 9jaz by Molmil
Cryo-EM structure of the class I amyloid-beta 42 fibril containing a D-Asp at position 23
Descriptor: Amyloid-beta precursor protein
Authors:Hsiao, L.C, Lee, C.H, Hsu, M.F, Hsu, S.T.
Deposit date:2024-08-26
Release date:2025-03-26
Last modified:2025-04-09
Method:ELECTRON MICROSCOPY (3 Å)
Cite:Impacts of D-aspartate on the Aggregation Kinetics and Structural Polymorphism of Amyloid beta Peptide 1-42.
J.Mol.Biol., 437, 2025
9JB0
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BU of 9jb0 by Molmil
Cryo-EM structure of the class II amyloid-beta 42 fibril containing a D-Asp at position 23
Descriptor: Amyloid-beta precursor protein
Authors:Hsiao, L.C, Lee, C.H, Hsu, M.F, Hsu, S.T.
Deposit date:2024-08-26
Release date:2025-03-26
Last modified:2025-04-09
Method:ELECTRON MICROSCOPY (2.9 Å)
Cite:Impacts of D-aspartate on the Aggregation Kinetics and Structural Polymorphism of Amyloid beta Peptide 1-42.
J.Mol.Biol., 437, 2025
9JB1
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BU of 9jb1 by Molmil
Cryo-EM structure of the type I amyloid-beta 42 fibril containing a D-Asp at positions 7 and 23
Descriptor: Amyloid-beta precursor protein
Authors:Hsiao, L.C, Lee, C.H, Hsu, M.F, Hsu, S.T.
Deposit date:2024-08-26
Release date:2025-03-26
Last modified:2025-04-09
Method:ELECTRON MICROSCOPY (2.5 Å)
Cite:Impacts of D-aspartate on the Aggregation Kinetics and Structural Polymorphism of Amyloid beta Peptide 1-42.
J.Mol.Biol., 437, 2025
5B6S
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BU of 5b6s by Molmil
Catalytic domain of Coprinopsis cinerea GH62 alpha-L-arabinofuranosidase
Descriptor: CALCIUM ION, GLYCEROL, Glycosyl hydrolase family 62 protein
Authors:Tonozuka, T.
Deposit date:2016-06-01
Release date:2016-09-07
Last modified:2024-11-20
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structure of the Catalytic Domain of alpha-L-Arabinofuranosidase from Coprinopsis cinerea, CcAbf62A, Provides Insights into Structure-Function Relationships in Glycoside Hydrolase Family 62
Appl. Biochem. Biotechnol., 181, 2017
7XOI
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BU of 7xoi by Molmil
Aspergillus sojae alpha-glucosidase AsojAgdL in complex with trehalose
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, SODIUM ION, ...
Authors:Tonozuka, T.
Deposit date:2022-05-01
Release date:2022-06-15
Last modified:2024-10-23
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structural basis for proteolytic processing of Aspergillus sojae alpha-glucosidase L with strong transglucosylation activity.
J.Struct.Biol., 214, 2022

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