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4BN5
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BU of 4bn5 by Molmil
Structure of human SIRT3 in complex with SRT1720 inhibitor
分子名称: CARBA-NICOTINAMIDE-ADENINE-DINUCLEOTIDE, GLYCEROL, N-{2-[3-(piperazin-1-ylmethyl)imidazo[2,1-b][1,3]thiazol-6-yl]phenyl}quinoxaline-2-carboxamide, ...
著者Nguyen, G.T.T, Schaefer, S, Gertz, M, Weyand, M, Steegborn, C.
登録日2013-05-13
公開日2013-06-26
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (3.25 Å)
主引用文献Structures of Human Sirtuin 3 Complexes with Adp-Ribose and with Carba-Nad+ and Srt1720: Binding Details and Inhibition Mechanism
Acta Crystallogr.,Sect.D, 69, 2013
7ALM
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BU of 7alm by Molmil
Crystal structure of human GDAP1 at 2.8 Angstrom resolution.
分子名称: Ganglioside-induced differentiation-associated protein 1
著者Nguyen, G.T.T, Sutinen, A, Raasakka, A, Kursula, P.
登録日2020-10-06
公開日2021-02-24
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Structure of the Complete Dimeric Human GDAP1 Core Domain Provides Insights into Ligand Binding and Clustering of Disease Mutations.
Front Mol Biosci, 7, 2020
7AIA
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BU of 7aia by Molmil
Complex of human GDAP1 with hexadecanedioic acid
分子名称: ETHANOL, GLYCEROL, Ganglioside-induced differentiation-associated protein 1, ...
著者Nguyen, G.T.T, Sutinen, A, Kursula, P.
登録日2020-09-26
公開日2021-02-24
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Structure of the Complete Dimeric Human GDAP1 Core Domain Provides Insights into Ligand Binding and Clustering of Disease Mutations.
Front Mol Biosci, 7, 2020
4C7B
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BU of 4c7b by Molmil
Complex of human Sirt3 with Bromo-Resveratrol and Fluor-De-Lys peptide
分子名称: 5-[(E)-2-(4-bromophenyl)ethenyl]benzene-1,3-diol, GLYCEROL, ISOPROPYL ALCOHOL, ...
著者Nguyen, G.T.T, Gertz, M, Weyand, M, Steegborn, C.
登録日2013-09-20
公開日2013-11-20
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Crystal Structures of Sirt3 Complexes with 4'-Bromo-Resveratrol Reveal Binding Sites and Inhibition Mechanism.
Chem.Biol., 20, 2013
4BN4
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BU of 4bn4 by Molmil
Structure of human SIRT3 in complex with ADP-ribose
分子名称: 2-[2-[2-[2-[2-(2-hydroxyethyloxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanoic acid, NAD-DEPENDENT PROTEIN DEACETYLASE SIRTUIN-3, MITOCHONDRIAL, ...
著者Nguyen, G.T.T, Schaefer, S, Gertz, M, Weyand, M, Steegborn, C.
登録日2013-05-13
公開日2013-06-26
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (1.3 Å)
主引用文献Structures of Human Sirtuin 3 Complexes with Adp-Ribose and with Carba-Nad+ and Srt1720: Binding Details and Inhibition Mechanism
Acta Crystallogr.,Sect.D, 69, 2013
4C78
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BU of 4c78 by Molmil
Complex of human Sirt3 with Bromo-Resveratrol and ACS2 peptide
分子名称: 5-[(E)-2-(4-bromophenyl)ethenyl]benzene-1,3-diol, ACETYL-COENZYME A SYNTHETASE 2-LIKE, MITOCHONDRIAL, ...
著者Nguyen, G.T.T, Gertz, M, Weyand, M, Steegborn, C.
登録日2013-09-19
公開日2013-11-20
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Crystal Structures of Sirt3 Complexes with 4'-Bromo-Resveratrol Reveal Binding Sites and Inhibition Mechanism.
Chem.Biol., 20, 2013
7B2G
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BU of 7b2g by Molmil
Crystal structure of R120Q GDAP1 mutant
分子名称: GLYCEROL, Ganglioside-induced differentiation-associated protein 1
著者Nguyen, G.T.T, Sutinen, A, Kursula, P.
登録日2020-11-26
公開日2021-12-08
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献Conserved intramolecular networks in GDAP1 are closely connected to CMT-linked mutations and protein stability.
Plos One, 18, 2023
3QBQ
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BU of 3qbq by Molmil
Crystal structure of extracellular domains of mouse RANK-RANKL complex
分子名称: Tumor necrosis factor ligand superfamily member 11, Tumor necrosis factor receptor superfamily member 11A
著者Ta, H.M, Nguyen, G.T.T, Jin, H.M, Choi, J.K, Park, H, Kim, N.S, Hwang, H.Y, Kim, K.K.
登録日2011-01-13
公開日2011-03-02
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Structure-based development of a receptor activator of nuclear factor-kappaB ligand (RANKL) inhibitor peptide and molecular basis for osteopetrosis
Proc.Natl.Acad.Sci.USA, 107, 2010
4HD8
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BU of 4hd8 by Molmil
Crystal structure of human Sirt3 in complex with Fluor-de-Lys peptide and piceatannol
分子名称: Fluor-de-Lys peptide, ISOPROPYL ALCOHOL, NAD-dependent protein deacetylase sirtuin-3, ...
著者Nguyen, G.T.T, Gertz, M, Steegborn, C.
登録日2012-10-02
公開日2012-12-05
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献A molecular mechanism for direct sirtuin activation by resveratrol.
Plos One, 7, 2012
4BVG
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BU of 4bvg by Molmil
CRYSTAL STRUCTURE OF HUMAN SIRT3 IN COMPLEX WITH NATIVE ALKYLIMIDATE FORMED FROM ACETYL-LYSINE ACS2-PEPTIDE CRYSTALLIZED IN PRESENCE OF THE INHIBITOR EX-527
分子名称: (2R,3R,4S,5R)-5-({[(R)-{[(R)-{[(2R,3S,4R,5R)-5-(6-AMINO-9H-PURIN-9-YL)-3,4-DIHYDROXYTETRAHYDROFURAN-2-YL]METHOXY}(HYDROXY)PHOSPHORYL]OXY}(HYDROXY)PHOSPHORYL]OXY}METHYL)-3,4-DIHYDROXYTETRAHYDROFURAN-2-YL ACETATE, 1,2-ETHANEDIOL, ACETYL-COENZYME A SYNTHETASE 2-LIKE, ...
著者Nguyen, G.T.T, Gertz, M, Weyand, M, Steegborn, C.
登録日2013-06-25
公開日2013-07-17
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Ex-527 inhibits Sirtuins by exploiting their unique NAD+-dependent deacetylation mechanism.
Proc. Natl. Acad. Sci. U.S.A., 110, 2013
4BVB
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BU of 4bvb by Molmil
CRYSTAL STRUCTURE OF HUMAN SIRT3 IN COMPLEX WITH THE INHIBITOR EX-527 AND ADP-RIBOSE
分子名称: (1S)-6-chloro-2,3,4,9-tetrahydro-1H-carbazole-1- carboxamide, NAD-DEPENDENT PROTEIN DEACETYLASE SIRTUIN-3, MITOCHONDRIAL, ...
著者Gertz, M, Weyand, M, Steegborn, C.
登録日2013-06-25
公開日2013-07-17
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Ex-527 Inhibits Sirtuins by Exploiting Their Unique Nad+-Dependent Deacetylation Mechanism
Proc.Natl.Acad.Sci.USA, 110, 2013
8A4J
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BU of 8a4j by Molmil
Human GDAP1, A247V mutant
分子名称: Ganglioside-induced differentiation-associated protein 1
著者Sutinen, A, Kursula, P.
登録日2022-06-12
公開日2023-04-26
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (2.68 Å)
主引用文献Conserved intramolecular networks in GDAP1 are closely connected to CMT-linked mutations and protein stability.
Plos One, 18, 2023
8A4K
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BU of 8a4k by Molmil
Human GDAP1, R282H mutant
分子名称: Ganglioside-induced differentiation-associated protein 1
著者Sutinen, A, Kursula, P.
登録日2022-06-12
公開日2023-04-26
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Conserved intramolecular networks in GDAP1 are closely connected to CMT-linked mutations and protein stability.
Plos One, 18, 2023
7YWD
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BU of 7ywd by Molmil
Human GDAP1 core domain, trigonal crystal form
分子名称: Ganglioside-induced differentiation-associated protein 1
著者Raasakka, A, Kursula, P.
登録日2022-02-13
公開日2022-06-08
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (3.2 Å)
主引用文献Structural insights into Charcot-Marie-Tooth disease-linked mutations in human GDAP1.
Febs Open Bio, 12, 2022
4BV3
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BU of 4bv3 by Molmil
CRYSTAL STRUCTURE OF SIRT3 IN COMPLEX WITH THE INHIBITOR EX-527 AND NAD
分子名称: (1S)-6-chloro-2,3,4,9-tetrahydro-1H-carbazole-1- carboxamide, ADENOSINE-5-DIPHOSPHORIBOSE, CHLORIDE ION, ...
著者Gertz, M, Nguyen, N.T.T, Weyand, M, Steegborn, C.
登録日2013-06-24
公開日2013-07-17
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Ex-527 Inhibits Sirtuins by Exploiting Their Unique Nad+-Dependent Deacetylation Mechanism
Proc.Natl.Acad.Sci.USA, 110, 2013
7Q6K
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BU of 7q6k by Molmil
Crystal structure of the human GDAP1 CMT2 mutant-R120W
分子名称: Ganglioside-induced differentiation-associated protein 1
著者Sutinen, A, Kursula, P.
登録日2021-11-08
公開日2022-06-08
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (3.41 Å)
主引用文献Structural insights into Charcot-Marie-Tooth disease-linked mutations in human GDAP1.
Febs Open Bio, 12, 2022
7Q6J
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BU of 7q6j by Molmil
Crystal structure of the human GDAP1 CMT2 mutant-H123R
分子名称: DI(HYDROXYETHYL)ETHER, Ganglioside-induced differentiation-associated protein 1
著者Sutinen, A, Kursula, P.
登録日2021-11-08
公開日2022-06-08
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Structural insights into Charcot-Marie-Tooth disease-linked mutations in human GDAP1.
Febs Open Bio, 12, 2022
4BVE
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BU of 4bve by Molmil
CRYSTAL STRUCTURE OF HUMAN SIRT3 IN COMPLEX WITH THIOALKYLIMIDATE FORMED FROM THIO-ACETYL-LYSINE ACS2-PEPTIDE
分子名称: 1,2-ETHANEDIOL, ACETYL-COENZYME A SYNTHETASE 2-LIKE, MITOCHONDRIAL, ...
著者Gertz, M, Weyand, M, Steegborn, C.
登録日2013-06-25
公開日2013-07-17
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Ex-527 Inhibits Sirtuins by Exploiting Their Unique Nad+-Dependent Deacetylation Mechanism
Proc.Natl.Acad.Sci.USA, 110, 2013
4BV2
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BU of 4bv2 by Molmil
CRYSTAL STRUCTURE OF SIR2 IN COMPLEX WITH THE INHIBITOR EX-527, 2'-O-ACETYL-ADP-RIBOSE AND DEACETYLATED P53-PEPTIDE
分子名称: (1S)-6-chloro-2,3,4,9-tetrahydro-1H-carbazole-1- carboxamide, 2'-O-ACETYL ADENOSINE-5-DIPHOSPHORIBOSE, CELLULAR TUMOR ANTIGEN P53, ...
著者Gertz, M, Weyand, M, Steegborn, C.
登録日2013-06-24
公開日2013-07-17
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (3.3 Å)
主引用文献Ex-527 Inhibits Sirtuins by Exploiting Their Unique Nad+-Dependent Deacetylation Mechanism
Proc.Natl.Acad.Sci.USA, 110, 2013
4BVH
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BU of 4bvh by Molmil
CRYSTAL STRUCTURE OF HUMAN SIRT3 IN COMPLEX WITH THE INHIBITOR EX-527 AND 2'-O-ACETYL-ADP-RIBOSE
分子名称: (1S)-6-chloro-2,3,4,9-tetrahydro-1H-carbazole-1- carboxamide, 1,2-ETHANEDIOL, 2'-O-ACETYL ADENOSINE-5-DIPHOSPHORIBOSE, ...
著者Gertz, M, Weyand, M, Steegborn, C.
登録日2013-06-25
公開日2013-07-17
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Ex-527 Inhibits Sirtuins by Exploiting Their Unique Nad+-Dependent Deacetylation Mechanism
Proc.Natl.Acad.Sci.USA, 110, 2013
4BUZ
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BU of 4buz by Molmil
SIR2 COMPLEX STRUCTURE MIXTURE OF EX-527 INHIBITOR AND REACTION PRODUCTS OR OF REACTION SUBSTRATES P53 PEPTIDE AND NAD
分子名称: (1S)-6-chloro-2,3,4,9-tetrahydro-1H-carbazole-1- carboxamide, 1,2-ETHANEDIOL, 2'-O-ACETYL ADENOSINE-5-DIPHOSPHORIBOSE, ...
著者Weyand, M, Lakshminarasimhan, M, Gertz, M, Steegborn, C.
登録日2013-06-24
公開日2013-07-17
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Ex-527 Inhibits Sirtuins by Exploiting Their Unique Nad+-Dependent Deacetylation Mechanism
Proc.Natl.Acad.Sci.USA, 110, 2013
4BVF
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BU of 4bvf by Molmil
CRYSTAL STRUCTURE OF HUMAN SIRT3 IN COMPLEX WITH THIOALKYLIMIDATE FORMED FROM THIO-ACETYL-LYSINE ACS2-PEPTIDE CRYSTALLIZED IN PRESENCE OF THE INHIBITOR EX-527
分子名称: 1,2-ETHANEDIOL, ACETYL-COENZYME A SYNTHETASE 2-LIKE, MITOCHONDRIAL, ...
著者Gertz, M, Weyand, M, Steegborn, C.
登録日2013-06-25
公開日2013-07-17
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献Ex-527 Inhibits Sirtuins by Exploiting Their Unique Nad+-Dependent Deacetylation Mechanism
Proc.Natl.Acad.Sci.USA, 110, 2013

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