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1A39
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HUMICOLA INSOLENS ENDOCELLULASE EGI S37W, P39W DOUBLE-MUTANT
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, ENDOGLUCANASE I
著者Davies, G.J, Ducros, V, Lewis, R.J, Borchert, T.V, Schulein, M.
登録日1998-01-28
公開日1999-03-02
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Oligosaccharide specificity of a family 7 endoglucanase: insertion of potential sugar-binding subsites.
J.Biotechnol., 57, 1997
1CNN
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OMEGA-CONOTOXIN MVIIC FROM CONUS MAGUS
分子名称: OMEGA-CONOTOXIN MVIIC
著者Nielsen, K.J, Adams, D, Thomas, L, Bond, T, Alewood, P.F, Craik, D.J, Lewis, R.J.
登録日1999-05-20
公開日2000-05-31
最終更新日2023-12-27
実験手法SOLUTION NMR
主引用文献Structure-activity relationships of omega-conotoxins MVIIA, MVIIC and 14 loop splice hybrids at N and P/Q-type calcium channels.
J.Mol.Biol., 289, 1999
1A0M
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BU of 1a0m by Molmil
1.1 ANGSTROM CRYSTAL STRUCTURE OF A-CONOTOXIN [TYR15]-EPI
分子名称: ALPHA-CONOTOXIN [TYR15]-EPI
著者Hu, S.-H, Loughnan, M, Miller, R, Weeks, C.M, Blessing, R.H, Alewood, P.F, Lewis, R.J, Martin, J.L.
登録日1997-12-03
公開日1999-01-13
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (1.1 Å)
主引用文献The 1.1 A resolution crystal structure of [Tyr15]EpI, a novel alpha-conotoxin from Conus episcopatus, solved by direct methods.
Biochemistry, 37, 1998
1E3A
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BU of 1e3a by Molmil
A slow processing precursor penicillin acylase from Escherichia coli
分子名称: 1,2-ETHANEDIOL, CALCIUM ION, CHLORIDE ION, ...
著者Hewitt, L, Kasche, V, Lummer, K, Lewis, R.J, Murshudov, G.N, Verma, C.S, Dodson, G.G, Wilson, K.S.
登録日2000-06-07
公開日2000-11-29
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Structure of a Slow Processing Precursor Penicillin Acylase from Escherichia Coli Reveals the Linker Peptide Blocking the Active-Site Cleft
J.Mol.Biol., 302, 2000
1AV3
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BU of 1av3 by Molmil
POTASSIUM CHANNEL BLOCKER KAPPA CONOTOXIN PVIIA FROM C. PURPURASCENS, NMR, 20 STRUCTURES
分子名称: Kappa-conotoxin PVIIA
著者Scanlon, M.J, Naranjo, D, Thomas, L, Alewood, P.F, Lewis, R.J, Craik, D.J.
登録日1997-09-24
公開日1998-10-14
最終更新日2020-12-16
実験手法SOLUTION NMR
主引用文献Solution structure and proposed binding mechanism of a novel potassium channel toxin kappa-conotoxin PVIIA.
Structure, 5, 1997
1TTL
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BU of 1ttl by Molmil
Omega-conotoxin GVIA, a N-type calcium channel blocker
分子名称: Omega-conotoxin GVIA
著者Mould, J, Yasuda, T, Schroeder, C.I, Beedle, A.M, Doering, C.J, Zamponi, G.W, Adams, D.J, Lewis, R.J.
登録日2004-06-23
公開日2004-07-13
最終更新日2011-07-13
実験手法SOLUTION NMR
主引用文献The alpha2delta auxiliary subunit reduces affinity of omega-conotoxins for recombinant N-type (Cav2.2) calcium channels
J.Biol.Chem., 279, 2004
1TR6
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BU of 1tr6 by Molmil
NMR solution structure of omega-conotoxin [K10]GVIA, a cyclic cysteine knot peptide
分子名称: Omega-conotoxin GVIA
著者Mould, J, Yasuda, T, Schroeder, C.I, Beedle, A.M, Doering, C.J, Zamponi, G.W, Adams, D.J, Lewis, R.J.
登録日2004-06-21
公開日2004-07-13
最終更新日2011-10-05
実験手法SOLUTION NMR
主引用文献The alpha2delta auxiliary subunit reduces affinity of omega-conotoxins for recombinant N-type (Cav2.2) calcium channels
J.Biol.Chem., 279, 2004
1R9I
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BU of 1r9i by Molmil
NMR Solution Structure of PIIIA toxin, NMR, 20 structures
分子名称: Mu-conotoxin PIIIA
著者Nielsen, K.J, Watson, M, Adams, D.J, Hammarstrom, A.K, Gage, P.W, Hill, J.M, Craik, D.J, Thomas, L, Adams, D, Alewood, P.F, Lewis, R.J.
登録日2003-10-30
公開日2003-11-18
最終更新日2019-12-25
実験手法SOLUTION NMR
主引用文献Solution structure of mu-conotoxin PIIIA, a preferential inhibitor of persistent tetrodotoxin-sensitive sodium channels
J.Biol.Chem., 277, 2002
1RMK
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BU of 1rmk by Molmil
Solution structure of conotoxin MrVIB
分子名称: Mu-O-conotoxin MrVIB
著者Daly, N.L, Ekberg, J.A, Thomas, L, Adams, D.J, Lewis, R.J, Craik, D.J.
登録日2003-11-28
公開日2004-09-07
最終更新日2022-03-02
実験手法SOLUTION NMR
主引用文献Structures of muO-conotoxins from Conus marmoreus. Inhibitors of tetrodotoxin (TTX)-sensitive and TTX-resistant sodium channels in mammalian sensory neurons
J.Biol.Chem., 279, 2004
9BFL
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BU of 9bfl by Molmil
Solution structure of the scorpion toxin omega-Buthitoxin-Hf1a
分子名称: Buthitoxin-Hf1a
著者Rosengren, K.J, Payne, C.D.
登録日2024-04-18
公開日2024-06-05
実験手法SOLUTION NMR
主引用文献Novel Scorpion Toxin omega-Buthitoxin-Hf1a Selectively Inhibits Calcium Influx via Ca V 3.3 and Ca V 3.2 and Alleviates Allodynia in a Mouse Model of Acute Postsurgical Pain.
Int J Mol Sci, 25, 2024
7O0I
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Vibrio vulnificus stressosome
分子名称: Anti-anti-sigma factor, RsbS, negative regulator of sigma-B
著者Kaltwasser, S, Heinz, V, Madej, M.G, Pane-Farre, J, Ziegler, C.
登録日2021-03-26
公開日2022-04-13
最終更新日2023-11-01
実験手法ELECTRON MICROSCOPY (8.3 Å)
主引用文献The Vibrio vulnificus stressosome is an oxygen-sensor involved in regulating iron metabolism
Commun Biol, 2022
8QHE
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BU of 8qhe by Molmil
Crystal structure IR-09
分子名称: 6-phosphogluconate dehydrogenase NADP-binding domain-containing protein, MAGNESIUM ION, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
著者Levy, C.W.
登録日2023-09-07
公開日2023-10-11
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Biocatalysis in Drug Design: Engineered Reductive Aminases (RedAms) Are Used to Access Chiral Building Blocks with Multiple Stereocenters.
J.Am.Chem.Soc., 145, 2023
7Q5H
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BU of 7q5h by Molmil
Keap1 compound complex
分子名称: (3S,5S,8R)-8-[[(2S)-1-ethanoylpyrrolidin-2-yl]carbonylamino]-N,N-dimethyl-3,7,11-tris(oxidanylidene)-10-oxa-3$l^{4}-thia-6-azabicyclo[10.4.0]hexadeca-1(16),12,14-triene-5-carboxamide, CHLORIDE ION, Kelch-like ECH-associated protein 1
著者Johansson, P.
登録日2021-11-03
公開日2022-03-16
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.31 Å)
主引用文献Importance of Binding Site Hydration and Flexibility Revealed When Optimizing a Macrocyclic Inhibitor of the Keap1-Nrf2 Protein-Protein Interaction.
J.Med.Chem., 65, 2022
7B3M
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MEK1 in complex with compound 6
分子名称: 1~{H}-indol-2-yl(pyridin-3-yl)methanone, Dual specificity mitogen-activated protein kinase kinase 1,Dual specificity mitogen-activated protein kinase kinase 1, MAGNESIUM ION, ...
著者Kack, H, Oster, L.
登録日2020-12-01
公開日2021-03-03
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Fragment-Based Discovery of Novel Allosteric MEK1 Binders.
Acs Med.Chem.Lett., 12, 2021
7B7R
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MEK1 in complex with compound 4
分子名称: 2-[5-[ethyl(methyl)amino]imidazo[1,2-a]pyrimidin-7-yl]phenol, Dual specificity mitogen-activated protein kinase kinase 1,Dual specificity mitogen-activated protein kinase kinase 1, MAGNESIUM ION, ...
著者Kack, H, Oster, L.
登録日2020-12-11
公開日2021-03-03
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Fragment-Based Discovery of Novel Allosteric MEK1 Binders.
Acs Med.Chem.Lett., 12, 2021
7B0U
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BU of 7b0u by Molmil
Stressosome complex from Listeria innocua
分子名称: RsbR protein, RsbS protein
著者Miksys, A, Fu, L, Madej, M.G, Ziegler, C.
登録日2020-11-22
公開日2021-12-01
最終更新日2022-07-20
実験手法ELECTRON MICROSCOPY (3.86 Å)
主引用文献Molecular insights into intra-complex signal transmission during stressosome activation.
Commun Biol, 5, 2022
7B9L
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BU of 7b9l by Molmil
MEK1 in complex with compound 23
分子名称: Dual specificity mitogen-activated protein kinase kinase 1,Dual specificity mitogen-activated protein kinase kinase 1, GLYCEROL, MAGNESIUM ION, ...
著者Kack, H, Oster, L.
登録日2020-12-14
公開日2021-03-03
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Fragment-Based Discovery of Novel Allosteric MEK1 Binders.
Acs Med.Chem.Lett., 12, 2021
7B94
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MEK1 in complex with compound 6
分子名称: 2-(4-iodophenyl)-8~{H}-imidazo[1,2-c]pyrimidin-5-one, Dual specificity mitogen-activated protein kinase kinase 1,Dual specificity mitogen-activated protein kinase kinase 1, MAGNESIUM ION, ...
著者Kack, H, Oster, L.
登録日2020-12-14
公開日2021-03-03
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Fragment-Based Discovery of Novel Allosteric MEK1 Binders.
Acs Med.Chem.Lett., 12, 2021
5T90
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BU of 5t90 by Molmil
Structural mechanisms for alpha-conotoxin selectivity at the human alpha3beta4 nicotinic acetylcholine receptor
分子名称: Acetylcholine-binding protein, LsIA
著者Abraham, N, Healy, M, Ragnarsson, L, Brust, A, Alewood, P, Lewis, R.
登録日2016-09-08
公開日2017-04-12
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Structural mechanisms for alpha-conotoxin activity at the human alpha 3 beta 4 nicotinic acetylcholine receptor.
Sci Rep, 7, 2017
6X8R
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BU of 6x8r by Molmil
Pharmacological characterisation and NMR structure of the novel mu-conotoxin SxIIIC, a potent irreversible NaV channel inhibitor
分子名称: SxIIIC peptide
著者Schroeder, C.I, McMahon, K.L.
登録日2020-06-01
公開日2020-10-21
最終更新日2023-06-14
実験手法SOLUTION NMR
主引用文献Discovery, Pharmacological Characterisation and NMR Structure of the Novel μ-Conotoxin SxIIIC, a Potent and Irreversible Na V Channel Inhibitor.
Biomedicines, 8, 2020
6KNO
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BU of 6kno by Molmil
Structure of single disulfide peptide Czon1107-P7A (minor conformer)
分子名称: Czon1107-P7A(minor conformer)
著者Sarma, S.P, Madhan Kumar, M.
登録日2019-08-06
公開日2020-04-08
最終更新日2023-06-14
実験手法SOLUTION NMR
主引用文献Structure and allosteric activity of a single-disulfide conopeptide fromConus zonatusat human alpha 3 beta 4 and alpha 7 nicotinic acetylcholine receptors.
J.Biol.Chem., 295, 2020
6KN3
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Structure of single disulfide peptide Czon1107-WT (minor conformer)
分子名称: Czon1107-WT(Conformer B)
著者Sarma, S.P, Madhan Kumar, M.
登録日2019-08-02
公開日2020-04-08
最終更新日2023-06-14
実験手法SOLUTION NMR
主引用文献Structure and allosteric activity of a single-disulfide conopeptide fromConus zonatusat human alpha 3 beta 4 and alpha 7 nicotinic acetylcholine receptors.
J.Biol.Chem., 295, 2020
6KNP
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Structure of single disulfide peptide Czon1107-P7A(major conformer)
分子名称: Czon1107-P7A(major)
著者Sarma, S.P, Madhan Kumar, M.
登録日2019-08-06
公開日2020-04-08
最終更新日2023-06-14
実験手法SOLUTION NMR
主引用文献Structure and allosteric activity of a single-disulfide conopeptide fromConus zonatusat human alpha 3 beta 4 and alpha 7 nicotinic acetylcholine receptors.
J.Biol.Chem., 295, 2020
6KN2
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Structure of single disulfide peptide Czon1107-WT (major conformer)
分子名称: Czon1107-WT (Conformer A)
著者Sarma, S.P, Madhan Kumar, M.
登録日2019-08-02
公開日2020-04-08
最終更新日2023-06-14
実験手法SOLUTION NMR
主引用文献Structure and allosteric activity of a single-disulfide conopeptide fromConus zonatusat human alpha 3 beta 4 and alpha 7 nicotinic acetylcholine receptors.
J.Biol.Chem., 295, 2020
6KMY
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Structure of single disulfide peptide Czon1107-P5A
分子名称: Czon1107-P5A
著者Sarma, S.P, Madhan Kumar, M.
登録日2019-08-01
公開日2020-04-08
最終更新日2023-06-14
実験手法SOLUTION NMR
主引用文献Structure and allosteric activity of a single-disulfide conopeptide fromConus zonatusat human alpha 3 beta 4 and alpha 7 nicotinic acetylcholine receptors.
J.Biol.Chem., 295, 2020

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