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8CN3
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BU of 8cn3 by Molmil
hDLG1-PDZ2 in complex with a TAX1 peptide from HTLV-1
分子名称: Disks large homolog 1, GLU-THR-GLU-VAL
著者Maseko, S, Sogues, A, Volkov, A, Remaut, H, Twizere, J.C.
登録日2023-02-21
公開日2023-08-02
最終更新日2024-06-19
実験手法X-RAY DIFFRACTION (2.71 Å)
主引用文献Identification of small molecule antivirals against HTLV-1 by targeting the hDLG1-Tax-1 protein-protein interaction.
Antiviral Res., 217, 2023
9FEB
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BU of 9feb by Molmil
Short-chain dehydrogenase/reductase (SDR) from Thermus caliditerrae in complex with NADP
分子名称: MAGNESIUM ION, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, SDR family oxidoreductase
著者Kapur, B, Nar, H.
登録日2024-05-17
公開日2024-06-26
実験手法X-RAY DIFFRACTION (1.698 Å)
主引用文献In silico enzyme screening identifies an SDR ketoreductase from Thermus caliditerrae as an attractive biocatalyst and promising candidate for protein engineering
Front Chem Biol, 2024
9FE6
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BU of 9fe6 by Molmil
Short-chain dehydrogenase/reductase (SDR) from Thermus caliditerrae
分子名称: MAGNESIUM ION, SDR family oxidoreductase
著者Kapur, B, Nar, H.
登録日2024-05-17
公開日2024-06-26
実験手法X-RAY DIFFRACTION (1.875 Å)
主引用文献In silico enzyme screening identifies an SDR ketoreductase from Thermus caliditerrae as an attractive biocatalyst and promising candidate for protein engineering
Front Chem Biol, 2024
8PI7
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BU of 8pi7 by Molmil
DNA binding domain of HNF-1A bound to P2-HNF4A promoter DNA variant (P2 -169C>T)
分子名称: CHLORIDE ION, Chains: E, Chains: F, ...
著者Kind, L, Myllykoski, M, Raasakka, A, Kursula, P.
登録日2023-06-21
公開日2024-06-19
実験手法X-RAY DIFFRACTION (3.2 Å)
主引用文献Molecular mechanism of HNF-1A-mediated HNF4A gene regulation and promoter-driven HNF4A-MODY diabetes.
JCI Insight, 9, 2024
8PIA
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BU of 8pia by Molmil
DNA binding domain of HNF-1A bound to P2-HNF4A promoter DNA variant (P2 -181G>T)
分子名称: Chains: E, Chains: F, GLYCEROL, ...
著者Kind, L, Myllykoski, M, Raasakka, A, Kursula, P.
登録日2023-06-21
公開日2024-06-19
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Molecular mechanism of HNF-1A-mediated HNF4A gene regulation and promoter-driven HNF4A-MODY diabetes.
JCI Insight, 9, 2024
8PI8
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BU of 8pi8 by Molmil
DNA binding domain of HNF-1A bound to P2-HNF4A promoter DNA
分子名称: Chains: E, Chains: F, GLYCEROL, ...
著者Kind, L, Myllykoski, M, Raasakka, A, Kursula, P.
登録日2023-06-21
公開日2024-06-19
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Molecular mechanism of HNF-1A-mediated HNF4A gene regulation and promoter-driven HNF4A-MODY diabetes.
JCI Insight, 9, 2024
8PI9
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BU of 8pi9 by Molmil
DNA binding domain of HNF-1A bound to P2-HNF4A promoter DNA variant (P2 -181G>A)
分子名称: Chains: E, Chains: F, Hepatocyte nuclear factor 1-alpha
著者Kind, L, Myllykoski, M, Raasakka, A, Kursula, P.
登録日2023-06-21
公開日2024-06-19
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Molecular mechanism of HNF-1A-mediated HNF4A gene regulation and promoter-driven HNF4A-MODY diabetes.
JCI Insight, 9, 2024
4UMI
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BU of 4umi by Molmil
Crystal structure of the fiber head domain of the Atadenovirus snake adenovirus 1, native, F23 crystal form
分子名称: FIBER PROTEIN
著者Singh, A.K, van Raaij, M.J.
登録日2014-05-17
公開日2014-12-17
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.33 Å)
主引用文献Crystal structure of the fibre head domain of the Atadenovirus Snake Adenovirus 1.
PLoS ONE, 9, 2014
6QI5
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BU of 6qi5 by Molmil
Near Atomic Structure of an Atadenovirus Shows a possible gene duplication event and Intergenera Variations in Cementing Proteins
分子名称: Hexon protein, PIIIa, Penton protein, ...
著者Condezo, G.N, Marabini, R, Gomez-Blanco, J, SanMartin, C.
登録日2019-01-17
公開日2020-08-05
最終更新日2024-05-15
実験手法ELECTRON MICROSCOPY (3.4 Å)
主引用文献Near-atomic structure of an atadenovirus reveals a conserved capsid-binding motif and intergenera variations in cementing proteins.
Sci Adv, 7, 2021
8EOC
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BU of 8eoc by Molmil
Crystal structure of E.coli DsbA mutant E24A/K58A
分子名称: COPPER (II) ION, GLYCEROL, Thiol:disulfide interchange protein DsbA
著者Wang, G, Heras, B.
登録日2022-10-03
公開日2023-02-15
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.47 Å)
主引用文献A Buried Water Network Modulates the Activity of the Escherichia coli Disulphide Catalyst DsbA.
Antioxidants, 12, 2023
8EQQ
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BU of 8eqq by Molmil
Crystal structure of E.coli DsbA mutant E37A
分子名称: CITRATE ANION, Thiol:disulfide interchange protein DsbA
著者Wang, G, Heras, B.
登録日2022-10-09
公開日2023-02-15
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2.13 Å)
主引用文献A Buried Water Network Modulates the Activity of the Escherichia coli Disulphide Catalyst DsbA.
Antioxidants, 12, 2023
8EQO
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BU of 8eqo by Molmil
Crystal structure of E.coli DsbA mutant K58A
分子名称: COPPER (II) ION, GLYCEROL, Thiol:disulfide interchange protein DsbA
著者Wang, G, Heras, B.
登録日2022-10-08
公開日2023-02-15
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.62 Å)
主引用文献A Buried Water Network Modulates the Activity of the Escherichia coli Disulphide Catalyst DsbA.
Antioxidants, 12, 2023
8EQP
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BU of 8eqp by Molmil
Crystal structure of E.coli DsbA mutant E24A/E37A/K58A
分子名称: CITRATE ANION, GLYCEROL, Thiol:disulfide interchange protein DsbA
著者Wang, G, Heras, B.
登録日2022-10-09
公開日2023-02-15
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献A Buried Water Network Modulates the Activity of the Escherichia coli Disulphide Catalyst DsbA.
Antioxidants, 12, 2023
8EQR
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BU of 8eqr by Molmil
Crystal structure of E.coli DsbA mutant E24A
分子名称: DI(HYDROXYETHYL)ETHER, Thiol:disulfide interchange protein DsbA
著者Wang, G, Heras, B.
登録日2022-10-09
公開日2023-02-15
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2.29 Å)
主引用文献A Buried Water Network Modulates the Activity of the Escherichia coli Disulphide Catalyst DsbA.
Antioxidants, 12, 2023
6NRH
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BU of 6nrh by Molmil
Crystal Structure of human PARP-1 ART domain bound inhibitor UTT63
分子名称: 3-hydroxy-2-({4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]phenyl}methyl)-1-benzofuran-7-carboxamide, DIMETHYL SULFOXIDE, Poly [ADP-ribose] polymerase 1, ...
著者Langelier, M.F, Pascal, J.M.
登録日2019-01-23
公開日2019-08-14
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Design and Synthesis of Poly(ADP-ribose) Polymerase Inhibitors: Impact of Adenosine Pocket-Binding Motif Appendage to the 3-Oxo-2,3-dihydrobenzofuran-7-carboxamide on Potency and Selectivity.
J.Med.Chem., 62, 2019
6NRJ
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BU of 6nrj by Molmil
Crystal Structure of human PARP-1 ART domain bound to inhibitor UTT93
分子名称: (2Z)-2-[(4-{[2-(1H-benzimidazol-2-yl)ethyl]carbamoyl}phenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-7-carboxamide, DIMETHYL SULFOXIDE, Poly [ADP-ribose] polymerase 1, ...
著者Langelier, M.F, Pascal, J.M.
登録日2019-01-23
公開日2019-08-14
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Design and Synthesis of Poly(ADP-ribose) Polymerase Inhibitors: Impact of Adenosine Pocket-Binding Motif Appendage to the 3-Oxo-2,3-dihydrobenzofuran-7-carboxamide on Potency and Selectivity.
J.Med.Chem., 62, 2019
6NRG
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BU of 6nrg by Molmil
Crystal Structure of human PARP-1 ART domain bound to inhibitor UTT57
分子名称: 2-{[3-fluoro-4-(1H-tetrazol-5-yl)phenyl]methyl}-3-hydroxy-1-benzofuran-7-carboxamide, DIMETHYL SULFOXIDE, Poly [ADP-ribose] polymerase 1, ...
著者Langelier, M.F, Pascal, J.M.
登録日2019-01-23
公開日2019-08-14
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Design and Synthesis of Poly(ADP-ribose) Polymerase Inhibitors: Impact of Adenosine Pocket-Binding Motif Appendage to the 3-Oxo-2,3-dihydrobenzofuran-7-carboxamide on Potency and Selectivity.
J.Med.Chem., 62, 2019
8BFR
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BU of 8bfr by Molmil
The E. coli TrpD2 protein YbiB at 1.3 A resolution
分子名称: GLYCEROL, Protein YbiB
著者Deckers, B, Galicia, C, Versees, W.
登録日2022-10-26
公開日2023-02-22
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.3 Å)
主引用文献YbiB: a novel interactor of the GTPase ObgE.
Nucleic Acids Res., 51, 2023
8BFT
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BU of 8bft by Molmil
The E. coli TrpD2 protein YbiB in complex with a C-terminal peptide from ObgE
分子名称: DI(HYDROXYETHYL)ETHER, GTPase ObgE/CgtA, Protein YbiB
著者Deckers, B, Galicia, C, Versees, W.
登録日2022-10-26
公開日2023-02-22
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.19 Å)
主引用文献YbiB: a novel interactor of the GTPase ObgE.
Nucleic Acids Res., 51, 2023
6NRF
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BU of 6nrf by Molmil
Crystal Structure of human PARP-1 ART domain bound to inhibitor UTT103
分子名称: 2-({4-[4-(1H-benzimidazol-2-yl)piperazine-1-carbonyl]phenyl}methyl)-3-hydroxy-1-benzofuran-7-carboxamide, CHLORIDE ION, CITRIC ACID, ...
著者Langelier, M.F, Pascal, J.M.
登録日2019-01-23
公開日2019-08-14
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Design and Synthesis of Poly(ADP-ribose) Polymerase Inhibitors: Impact of Adenosine Pocket-Binding Motif Appendage to the 3-Oxo-2,3-dihydrobenzofuran-7-carboxamide on Potency and Selectivity.
J.Med.Chem., 62, 2019
6NRI
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BU of 6nri by Molmil
Crystal Structure of human PARP-1 ART domain bound to inhibitor UTT83
分子名称: (2Z)-2-{[4-(3-cyclopropyl-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carbonyl)phenyl]methylidene}-3-oxo-2,3-dihydro-1-benzofuran-7-carboxamide, CHLORIDE ION, CITRIC ACID, ...
著者Langelier, M.F, Pascal, J.M.
登録日2019-01-23
公開日2019-08-14
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Design and Synthesis of Poly(ADP-ribose) Polymerase Inhibitors: Impact of Adenosine Pocket-Binding Motif Appendage to the 3-Oxo-2,3-dihydrobenzofuran-7-carboxamide on Potency and Selectivity.
J.Med.Chem., 62, 2019
3IKP
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BU of 3ikp by Molmil
Crystal structure of inositol phosphate bound trimeric human lung surfactant protein D
分子名称: CALCIUM ION, D-MYO-INOSITOL-1-PHOSPHATE, Pulmonary surfactant-associated protein D
著者Shrive, A.K, Greenhough, T.J.
登録日2009-08-06
公開日2009-11-17
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Structural characterisation of ligand-binding determinants in human lung surfactant protein D: influence of Asp325
J.Mol.Biol., 394, 2009
3IKN
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BU of 3ikn by Molmil
Crystal structure of galactose bound trimeric human lung surfactant protein D
分子名称: CALCIUM ION, Pulmonary surfactant-associated protein D, beta-D-galactopyranose
著者Shrive, A.K, Greenhough, T.J.
登録日2009-08-06
公開日2009-11-17
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Structural characterisation of ligand-binding determinants in human lung surfactant protein D: influence of Asp325
J.Mol.Biol., 394, 2009
3IKR
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BU of 3ikr by Molmil
Crystal structure of alpha 1-4 mannobiose bound trimeric human lung surfactant protein D
分子名称: CALCIUM ION, Pulmonary surfactant-associated protein D, alpha-D-mannopyranose
著者Shrive, A.K, Greenhough, T.J.
登録日2009-08-06
公開日2009-11-17
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Structural characterisation of ligand-binding determinants in human lung surfactant protein D: influence of Asp325
J.Mol.Biol., 394, 2009
3IKQ
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BU of 3ikq by Molmil
Crystal structure of alpha 1-2 mannobiose bound trimeric human lung surfactant protein D
分子名称: CALCIUM ION, Pulmonary surfactant-associated protein D, alpha-D-mannopyranose
著者Shrive, A.K, Greenhough, T.J.
登録日2009-08-06
公開日2009-11-17
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.25 Å)
主引用文献Structural characterisation of ligand-binding determinants in human lung surfactant protein D: influence of Asp325
J.Mol.Biol., 394, 2009

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件を2024-08-28に公開中

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