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5W4J
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BU of 5w4j by Molmil
X-ray crystallographic structure of a beta-hairpin peptide mimic. (ORN)KLV(MEA)FAE(ORN)AIIGLMV.
分子名称: A-beta 17_36 peptide: ORN-LYS-VAL-PHE-MEA-ALA-ALA-ASP-ORN-ALA-ILE-ILE-GLY-LEU-MET-VAL
著者Kreutzer, A.G, Nowick, J.S.
登録日2017-06-11
公開日2017-11-22
最終更新日2025-04-02
実験手法X-RAY DIFFRACTION (2.08 Å)
主引用文献A Hexamer of a Peptide Derived from A beta 16-36.
Biochemistry, 56, 2017
5W4I
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X-ray crystallographic structure of a beta-hairpin peptide mimic derived from Abeta 16-36. Rigaku data set. (ORN)KLV(MEA)FAE(ORN)AIIGLMV.
分子名称: A-beta 17_36: ORN-LYS-LEU-VAL-MEA-PHE-ALA-GLU-ORN-ALA-ILE-ILE-GLY-LEU-MET-VAL, CHLORIDE ION, IODIDE ION
著者Kreutzer, A.G, McKnelly, K.J, Nowick, J.S.
登録日2017-06-11
公開日2017-11-22
最終更新日2025-04-02
実験手法X-RAY DIFFRACTION (2.026 Å)
主引用文献A Hexamer of a Peptide Derived from A beta 16-36.
Biochemistry, 56, 2017
1AXL
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BU of 1axl by Molmil
SOLUTION CONFORMATION OF THE (-)-TRANS-ANTI-[BP]DG ADDUCT OPPOSITE A DELETION SITE IN DNA DUPLEX D(CCATC-[BP]G-CTACC)D(GGTAG--GATGG), NMR, 6 STRUCTURES
分子名称: 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE, DNA DUPLEX D(CCATC-[BP]G-CTACC)D(GGTAG--GATGG)
著者Feng, B, Gorin, A.A, Kolbanovskiy, A, Hingerty, B.E, Geacintov, N.E, Broyde, S, Patel, D.J.
登録日1997-10-16
公開日1998-07-01
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献Solution conformation of the (-)-trans-anti-[BP]dG adduct opposite a deletion site in a DNA duplex: intercalation of the covalently attached benzo[a]pyrene into the helix with base displacement of the modified deoxyguanosine into the minor groove.
Biochemistry, 36, 1997
6BKO
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BU of 6bko by Molmil
Crystal structure of the A/Wyoming/3/2003 (H3N2) influenza virus hemagglutinin D190E mutant apo form
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Hemagglutinin, ...
著者Wu, N.C, Wilson, I.A.
登録日2017-11-09
公開日2018-02-28
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献A complex epistatic network limits the mutational reversibility in the influenza hemagglutinin receptor-binding site.
Nat Commun, 9, 2018
3HTO
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the hemagglutinin structure of an avian H1N1 influenza A virus
分子名称: 2-acetamido-2-deoxy-alpha-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose, Hemagglutinin, ...
著者Wang, G, Li, A, Zhang, Q, Wu, C, Zhang, R, Cai, Q, Song, W, Yuen, K.-Y.
登録日2009-06-12
公開日2009-08-11
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (2.95 Å)
主引用文献The hemagglutinin structure of an avian H1N1 influenza A virus
Virology, 392, 2009
6BKS
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BU of 6bks by Molmil
Crystal structure of the A/Wyoming/3/2003 (H3N2) influenza virus hemagglutinin D190E mutant in complex with 6'-SLN
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Hemagglutinin, ...
著者Wu, N.C, Wilson, I.A.
登録日2017-11-09
公開日2018-02-28
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献A complex epistatic network limits the mutational reversibility in the influenza hemagglutinin receptor-binding site.
Nat Commun, 9, 2018
3HTP
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the hemagglutinin structure of an avian H1N1 influenza A virus in complex with LSTa
分子名称: 2-acetamido-2-deoxy-alpha-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose, Hemagglutinin, ...
著者Wang, G, Li, A, Zhang, Q, Wu, C, Zhang, R, Cai, Q, Song, W, Yuen, K.-Y.
登録日2009-06-12
公開日2009-08-11
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (2.96 Å)
主引用文献The hemagglutinin structure of an avian H1N1 influenza A virus
Virology, 392, 2009
3HTT
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The hemagglutinin structure of an avian H1N1 influenza A virus in complex with 2,3-sialyllactose
分子名称: 2-acetamido-2-deoxy-alpha-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose, Hemagglutinin, ...
著者Wang, G, Li, A, Zhang, Q, Wu, C, Zhang, R, Cai, Q, Song, W, Yuen, K.-Y.
登録日2009-06-12
公開日2009-08-11
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (2.95 Å)
主引用文献The hemagglutinin structure of an avian H1N1 influenza A virus
Virology, 392, 2009
3HTQ
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BU of 3htq by Molmil
the hemagglutinin structure of an avian H1N1 influenza A virus in complex with LSTc
分子名称: 2-acetamido-2-deoxy-alpha-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose, Hemagglutinin, ...
著者Wang, G, Li, A, Zhang, Q, Wu, C, Zhang, R, Cai, Q, Song, W, Yuen, K.-Y.
登録日2009-06-12
公開日2009-08-11
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (2.955 Å)
主引用文献The hemagglutinin structure of an avian H1N1 influenza A virus
Virology, 392, 2009
4BZN
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BU of 4bzn by Molmil
Crystal structure of PIM1 in complex with a Pyrrolo(1,2-a)Pyrazinone inhibitor
分子名称: N-(2,2-dimethylpropyl)-2-[1-oxo-7-(thiophen-3-yl)-1,2,3,4-tetrahydropyrrolo[1,2-a]pyrazin-4-yl]acetamide, SERINE/THREONINE-PROTEIN KINASE PIM-1
著者Casale, E, Casuscelli, F, Ardini, E, Avanzi, N, Cervi, G, D'Anello, M, Donati, D, Faiardi, D, Ferguson, R.D, Fogliatto, G, Galvani, A, Marsiglio, A, Mirizzi, D.G, Montemartini, M, Orrenius, C, Papeo, G, Piutti, C, Salom, B, Felder, E.R.
登録日2013-07-29
公開日2013-10-30
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Discovery and Optimization of Pyrrolo[1,2-A]Pyrazinones Leads to Novel and Selective Inhibitors of Pim Kinases.
Bioorg.Med.Chem., 21, 2013
4BZO
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BU of 4bzo by Molmil
Crystal structure of PIM1 in complex with a Pyrrolo-Pyrazinone inhibitor
分子名称: N-[(1S)-2-AMINO-1-PHENYLETHYL]-2-[(4S)-7-(2-FLUORO-4-PYRIDINYL)-1-OXO-1,2,3,4-TETRAHYDROPYRROLO[1,2-A]PYRAZIN-4-YL]ACETAMIDE, SERINE/THREONINE-PROTEIN KINASE PIM-1
著者Casale, E, Casuscelli, F, Ardini, E, Avanzi, N, Cervi, G, D'Anello, M, Donati, D, Faiardi, D, Ferguson, R.D, Fogliatto, G, Galvani, A, Marsiglio, A, Mirizzi, D.G, Montemartini, M, Orrenius, C, Papeo, G, Piutti, C, Salom, B, Felder, E.R.
登録日2013-07-29
公開日2013-10-30
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Discovery and Optimization of Pyrrolo[1,2-A]Pyrazinones Leads to Novel and Selective Inhibitors of Pim Kinases.
Bioorg.Med.Chem., 21, 2013
3BO2
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BU of 3bo2 by Molmil
A relaxed active site following exon ligation by a group I intron
分子名称: Group I intron P9, MAGNESIUM ION, RNA (5'-R(*AP*AP*GP*CP*CP*AP*CP*AP*CP*AP*AP*AP*CP*CP*AP*G)-3'), ...
著者Lipchock, S.V, Strobel, S.A.
登録日2007-12-17
公開日2008-04-01
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (3.31 Å)
主引用文献A relaxed active site after exon ligation by the group I intron
Proc.Natl.Acad.Sci.Usa, 105, 2008
1ZI0
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BU of 1zi0 by Molmil
A Superhelical Spiral in Escherichia coli DNA Gyrase A C-terminal Domain Imparts Unidirectional Supercoiling Bias
分子名称: DNA gyrase subunit A
著者Ruthenburg, A.J, Graybosch, D.M, Huetsch, J.C, Verdine, G.L.
登録日2005-04-26
公開日2005-05-24
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献A superhelical spiral in the Escherichia coli DNA gyrase A C-terminal domain imparts unidirectional supercoiling bias
J.Biol.Chem., 280, 2005
1OH1
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BU of 1oh1 by Molmil
Solution structure of staphostatin A form Staphylococcus aureus confirms the discovery of a novel class of cysteine proteinase inhibitors.
分子名称: STAPHOSTATIN A
著者Dubin, G, Popowicz, G, Krajewski, M, Stec, J, Bochtler, M, Potempa, J, Dubin, A, Holak, T.A.
登録日2003-05-21
公開日2003-11-20
最終更新日2024-11-13
実験手法SOLUTION NMR
主引用文献A Novel Class of Cysteine Protease Inhibitors: Solution Structure of Staphostatin a from Staphylococcus Aureus
Biochemistry, 42, 2003
3BO3
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BU of 3bo3 by Molmil
A relaxed active site following exon ligation by a group I intron
分子名称: Group I intron P9, MAGNESIUM ION, POTASSIUM ION, ...
著者Lipchock, S.V, Strobel, S.A.
登録日2007-12-17
公開日2008-04-01
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (3.4 Å)
主引用文献A relaxed active site after exon ligation by the group I intron
Proc.Natl.Acad.Sci.Usa, 105, 2008
3T3M
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BU of 3t3m by Molmil
A Novel High Affinity Integrin alphaIIbbeta3 Receptor Antagonist That Unexpectedly Displaces Mg2+ from the beta3 MIDAS
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, ...
著者Zhu, J, Zhu, J, Springer, T.A.
登録日2011-07-25
公開日2012-03-28
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Structure-Guided Design of a High-Affinity Platelet Integrin alphaIIbbeta3 Receptor Antagonist That Disrupts Mg2+ Binding to the MIDAS
Sci Transl Med, 4, 2012
1VLN
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BU of 1vln by Molmil
A TRICLINIC CRYSTAL FORM OF THE LECTIN CONCANAVALIN A
分子名称: CALCIUM ION, CONCANAVALIN A, MANGANESE (II) ION
著者Kanellopoulos, P.N, Tucker, P.A, Hamodrakas, S.J.
登録日1996-04-03
公開日1997-04-01
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献A Triclinic Crystal Form of the Lectin Concanavalin A
J.Struct.Biol., 117, 1996
3CGO
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BU of 3cgo by Molmil
IRAK-4 Inhibitors (Part II)- A structure based assessment of imidazo[1,2 a]pyridine binding
分子名称: 2-{4-[(4-imidazo[1,2-a]pyridin-3-ylpyrimidin-2-yl)amino]piperidin-1-yl}-N-methylacetamide, Mitogen-activated protein kinase 10
著者Ceska, T.A, Platt, A, Fortunato, M, Dickson, K.M, Beevers, R.
登録日2008-03-06
公開日2008-06-03
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献IRAK-4 inhibitors. Part II: A structure-based assessment of imidazo[1,2-a]pyridine binding
Bioorg.Med.Chem.Lett., 18, 2008
3CGF
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IRAK-4 Inhibitors (Part II)- A structure based assessment of imidazo[1,2 a]pyridine binding
分子名称: Mitogen-activated protein kinase 10, N-cyclohexyl-4-imidazo[1,2-a]pyridin-3-yl-N-methylpyrimidin-2-amine
著者Ceska, T.A, Platt, A, Fortunato, M, Dickson, K.M, Buckley, G.
登録日2008-03-05
公開日2008-06-03
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献IRAK-4 inhibitors. Part II: A structure-based assessment of imidazo[1,2-a]pyridine binding
Bioorg.Med.Chem.Lett., 18, 2008
2KZG
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BU of 2kzg by Molmil
A Transient and Low Populated Protein Folding Intermediate at Atomic Resolution
分子名称: Pre-mRNA-processing factor 40 homolog A
著者Korzhnev, D.M, Religa, T.L, Banachewicz, W, Fersht, A.R, Kay, L.E.
登録日2010-06-17
公開日2010-09-29
最終更新日2024-05-01
実験手法SOLUTION NMR
主引用文献A transient and low-populated protein-folding intermediate at atomic resolution.
Science, 329, 2010
3BO4
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BU of 3bo4 by Molmil
A relaxed active site following exon ligation by a group I intron
分子名称: DNA/RNA (5'-R(*AP*AP*GP*CP*CP*AP*CP*AP*CP*AP*AP*AP*CP*CP*A)-D(P*DG)-3'), DNA/RNA (5'-R(*CP*A)-D(P*DU)-R(P*AP*CP*GP*GP*CP*C)-3'), Group I intron P9, ...
著者Lipchock, S.V, Strobel, S.A.
登録日2007-12-17
公開日2008-04-01
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (3.33 Å)
主引用文献A relaxed active site after exon ligation by the group I intron
Proc.Natl.Acad.Sci.Usa, 105, 2008
3NUH
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BU of 3nuh by Molmil
A domain insertion in E. coli GyrB adopts a novel fold that plays a critical role in gyrase function
分子名称: DNA gyrase subunit A, DNA gyrase subunit B, MAGNESIUM ION
著者Schoeffler, A.J, May, A.P, Berger, J.M.
登録日2010-07-06
公開日2010-08-11
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (3.103 Å)
主引用文献A domain insertion in Escherichia coli GyrB adopts a novel fold that plays a critical role in gyrase function.
Nucleic Acids Res., 38, 2010
3O9S
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Effector domain of influenza A/PR/8/34 NS1
分子名称: Nonstructural protein 1
著者Kerry, P.S, Lewis, A, Hale, B.G, Hass, C, Taylor, M.A, Randall, R.E, Russell, R.J.M.
登録日2010-08-04
公開日2011-05-11
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.48 Å)
主引用文献A Transient Homotypic Interaction Model for the Influenza A Virus NS1 Protein Effector Domain.
Plos One, 6, 2011
3O9R
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Effector domain of NS1 from influenza A/PR/8/34 containing a W187A mutation
分子名称: Nonstructural protein 1
著者Kerry, P.S, Lewis, A, Hale, B.G, Hass, C, Taylor, M.A, Randall, R.E, Russell, R.J.M.
登録日2010-08-04
公開日2011-05-11
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献A Transient Homotypic Interaction Model for the Influenza A Virus NS1 Protein Effector Domain.
Plos One, 6, 2011
3O9Q
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Effector domain of NS1 from A/PR/8/34 containing a W187A mutation
分子名称: Nonstructural protein 1
著者Kerry, P.S, Lewis, A, Hale, B.G, Hass, C, Taylor, M.A, Randall, R.E, Russell, R.J.M.
登録日2010-08-04
公開日2011-05-18
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献A Transient Homotypic Interaction Model for the Influenza A Virus NS1 Protein Effector Domain.
Plos One, 6, 2011

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件を2025-07-09に公開中

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