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7QJQ
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Crystal structure of a cutinase enzyme from Thermobifida fusca NTU22 (702)
分子名称: Acetylxylan esterase, DI(HYDROXYETHYL)ETHER
著者Zahn, M, Gill, R.S, Avilan, L, Beckham, G.T, McGeehan, J.E.
登録日2021-12-17
公開日2022-12-28
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.64 Å)
主引用文献Sourcing thermotolerant poly(ethylene terephthalate) hydrolase scaffolds from natural diversity
Nat Commun, 13, 2022
7QJN
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Crystal structure of an alpha/beta-hydrolase enzyme from Candidatus Kryptobacter tengchongensis (306)
分子名称: Dienelactone hydrolase, PHOSPHATE ION
著者Zahn, M, Gill, R.S, Erickson, E, Beckham, G.T, McGeehan, J.E.
登録日2021-12-17
公開日2022-12-28
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (1.885 Å)
主引用文献Sourcing thermotolerant poly(ethylene terephthalate) hydrolase scaffolds from natural diversity
Nat Commun, 13, 2022
1LEM
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BU of 1lem by Molmil
THE MONOSACCHARIDE BINDING SITE OF LENTIL LECTIN: AN X-RAY AND MOLECULAR MODELLING STUDY
分子名称: CALCIUM ION, LECTIN, MANGANESE (II) ION, ...
著者Loris, R, Wyns, L.
登録日1993-11-17
公開日1994-01-31
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献The monosaccharide binding site of lentil lectin: an X-ray and molecular modelling study.
Glycoconj.J., 11, 1994
8TU3
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BU of 8tu3 by Molmil
Bruton's tyrosine kinase in complex with covalent inhibitor compound 10
分子名称: 1-[(4R)-4-{[(6P,8S)-6-(1-methyl-1H-pyrazol-4-yl)pyrazolo[1,5-a]pyrazin-4-yl]oxy}azepan-1-yl]propan-1-one, Tyrosine-protein kinase BTK
著者Metrick, C.M.
登録日2023-08-15
公開日2024-06-26
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Discovery and Preclinical Characterization of BIIB129, a Covalent, Selective, and Brain-Penetrant BTK Inhibitor for the Treatment of Multiple Sclerosis.
J.Med.Chem., 67, 2024
8TU4
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Bruton's tyrosine kinase in complex with covalent inhibitor compound 25
分子名称: N-methyl-N-[(1S,3r)-3-methyl-3-{[(6M,8S)-6-(1-methyl-1H-pyrazol-4-yl)pyrazolo[1,5-a]pyrazin-4-yl]oxy}cyclobutyl]propanamide, Tyrosine-protein kinase BTK
著者Metrick, C.M.
登録日2023-08-15
公開日2024-06-26
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Discovery and Preclinical Characterization of BIIB129, a Covalent, Selective, and Brain-Penetrant BTK Inhibitor for the Treatment of Multiple Sclerosis.
J.Med.Chem., 67, 2024
8TU5
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Bruton's tyrosine kinase in complex with covalent inhibitor compound 27
分子名称: 1-[(1S,5S,6S)-6-methyl-6-{[(6M,8R)-6-(1-methyl-1H-pyrazol-4-yl)pyrazolo[1,5-a]pyrazin-4-yl]oxy}-2-azabicyclo[3.2.0]heptan-2-yl]propan-1-one, Tyrosine-protein kinase BTK
著者Metrick, C.M.
登録日2023-08-15
公開日2024-06-26
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Discovery and Preclinical Characterization of BIIB129, a Covalent, Selective, and Brain-Penetrant BTK Inhibitor for the Treatment of Multiple Sclerosis.
J.Med.Chem., 67, 2024
7MU6
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Ask1 bound to compound 28
分子名称: 2-methoxy-N-(6-{4-[(2S)-1,1,1-trifluoropropan-2-yl]-4H-1,2,4-triazol-3-yl}pyridin-2-yl)pyridine-3-carboxamide, Mitogen-activated protein kinase kinase kinase 5
著者Chodaparambil, J.V, Marcotte, D.J.
登録日2021-05-14
公開日2024-07-17
実験手法X-RAY DIFFRACTION (2.165 Å)
主引用文献Discovery of Potent, Selective, and Brain-Penetrant Apoptosis Signal-Regulating Kinase 1 (ASK1) Inhibitors that Modulate Brain Inflammation In Vivo.
J.Med.Chem., 64, 2021
7MZV
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Structure of yeast pseudouridine synthase 7 (PUS7)
分子名称: Multisubstrate pseudouridine synthase 7, SULFATE ION
著者Purchal, M, Koutmos, M.
登録日2021-05-24
公開日2022-02-09
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (3.2 Å)
主引用文献Pseudouridine synthase 7 is an opportunistic enzyme that binds and modifies substrates with diverse sequences and structures.
Proc.Natl.Acad.Sci.USA, 119, 2022
7QJM
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BU of 7qjm by Molmil
Crystal structure of an alpha/beta-hydrolase enzyme from Chloroflexus sp. MS-G (202)
分子名称: alpha/beta-hydrolase (202)
著者Zahn, M, Graham, R, Beckham, G.T, McGeehan, J.E.
登録日2021-12-17
公開日2022-12-28
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.19 Å)
主引用文献Sourcing thermotolerant poly(ethylene terephthalate) hydrolase scaffolds from natural diversity
Nat Commun, 13, 2022
5J79
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BU of 5j79 by Molmil
The identification and pharmacological characterization of 6-(tert-butylsulfonyl)-N-(5-fluoro-1H-indazol-3-yl)quinolin-4-amine (GSK583), a highly potent and selective inhibitor of RIP2 Kinase, Compound 3 complex
分子名称: 4-methyl-3-{[6-(methylsulfonyl)quinolin-4-yl]amino}phenol, Receptor-interacting serine/threonine-protein kinase 2, SULFATE ION
著者Convery, M.A, Casillas, L.N, Haile, P.A, Votta, B.J, Lakdawala, A.S.
登録日2016-04-06
公開日2016-05-18
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.69 Å)
主引用文献The Identification and Pharmacological Characterization of 6-(tert-Butylsulfonyl)-N-(5-fluoro-1H-indazol-3-yl)quinolin-4-amine (GSK583), a Highly Potent and Selective Inhibitor of RIP2 Kinase.
J.Med.Chem., 59, 2016
5J7B
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BU of 5j7b by Molmil
The identification and pharmacological characterization of 6-(tert-butylsulfonyl)-N-(5-fluoro-1H-indazol-3-yl)quinolin-4-amine (GSK583), a highly potent and selective inhibitor of RIP2 Kinase, GSK583 complex
分子名称: 6-(tert-butylsulfonyl)-N-(5-fluoro-2H-indazol-3-yl)quinolin-4-amine, Receptor-interacting serine/threonine-protein kinase 2
著者Convery, M.A, Casillas, L.N, Haile, P.A, Votta, B.J, Lakdawala, A.S.
登録日2016-04-06
公開日2016-05-18
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.53 Å)
主引用文献The Identification and Pharmacological Characterization of 6-(tert-Butylsulfonyl)-N-(5-fluoro-1H-indazol-3-yl)quinolin-4-amine (GSK583), a Highly Potent and Selective Inhibitor of RIP2 Kinase.
J.Med.Chem., 59, 2016
5J67
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BU of 5j67 by Molmil
Structure of Astrotactin-2, a conserved vertebrate-specific and perforin-like membrane protein involved in neuronal development
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, Astrotactin-2, D-MYO-INOSITOL-1,4,5-TRIPHOSPHATE, ...
著者Ni, T, Harlos, K, Gilbert, R.J.C.
登録日2016-04-04
公開日2016-05-25
最終更新日2020-07-29
実験手法X-RAY DIFFRACTION (3.16 Å)
主引用文献Structure of astrotactin-2: a conserved vertebrate-specific and perforin-like membrane protein involved in neuronal development.
Open Biology, 6, 2016
5C37
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BU of 5c37 by Molmil
Structure of the beta-ketoacyl reductase domain of human fatty acid synthase bound to a spiro-imidazolone inhibitor
分子名称: 6-{[(3R)-1-(cyclopropylcarbonyl)pyrrolidin-3-yl]methyl}-5-[4-(1-methyl-1H-indazol-5-yl)phenyl]-4,6-diazaspiro[2.4]hept-4-en-7-one, CHLORIDE ION, Fatty acid synthase, ...
著者Schubert, C, Milligan, C.M, Vo, K, Grasberger, B.
登録日2015-06-17
公開日2016-06-22
最終更新日2024-06-19
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Design and synthesis of a series of bioavailable fatty acid synthase (FASN) KR domain inhibitors for cancer therapy.
Bioorg.Med.Chem.Lett., 28, 2018
5J69
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BU of 5j69 by Molmil
Structure of Astrotactin-2, a conserved vertebrate-specific and perforin-like membrane protein involved in neuronal development
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, Astrotactin-2
著者Ni, T, Harlos, K, Gilbert, R.J.C.
登録日2016-04-04
公開日2016-05-25
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (3.63 Å)
主引用文献Structure of astrotactin-2: a conserved vertebrate-specific and perforin-like membrane protein involved in neuronal development.
Open Biology, 6, 2016
5J68
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BU of 5j68 by Molmil
Structure of Astrotactin-2, a conserved vertebrate-specific and perforin-like membrane protein involved in neuronal development
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, Astrotactin-2, D-MYO-INOSITOL-1,4,5-TRIPHOSPHATE, ...
著者Ni, T, Harlos, K, Gilbert, R.J.C.
登録日2016-04-04
公開日2016-05-25
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (5.221 Å)
主引用文献Structure of astrotactin-2: a conserved vertebrate-specific and perforin-like membrane protein involved in neuronal development.
Open Biology, 6, 2016
7QJR
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BU of 7qjr by Molmil
Crystal structure of cutinase 1 from Thermobifida fusca DSM44342 (703)
分子名称: Cutinase 1, TETRAETHYLENE GLYCOL
著者Zahn, M, Avilan, L, Beckham, G.T, McGeehan, J.E.
登録日2021-12-17
公開日2022-12-28
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.51 Å)
主引用文献Sourcing thermotolerant poly(ethylene terephthalate) hydrolase scaffolds from natural diversity
Nat Commun, 13, 2022
7QJT
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BU of 7qjt by Molmil
Crystal structure of a cutinase enzyme from Thermobifida cellulosilytica TB100 (711)
分子名称: GLYCEROL, MAGNESIUM ION, TETRAETHYLENE GLYCOL, ...
著者Zahn, M, Shakespeare, T.J, Beckham, G.T, McGeehan, J.E.
登録日2021-12-17
公開日2022-12-28
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.78 Å)
主引用文献Sourcing thermotolerant poly(ethylene terephthalate) hydrolase scaffolds from natural diversity
Nat Commun, 13, 2022
7QJP
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BU of 7qjp by Molmil
Crystal structure of a cutinase enzyme from Saccharopolyspora flava (611)
分子名称: Cutinase, TETRAETHYLENE GLYCOL
著者Zahn, M, Avilan, L, Beckham, G.T, McGeehan, J.E.
登録日2021-12-17
公開日2022-12-28
最終更新日2024-04-24
実験手法X-RAY DIFFRACTION (1.561 Å)
主引用文献Sourcing thermotolerant poly(ethylene terephthalate) hydrolase scaffolds from natural diversity
Nat Commun, 13, 2022
7QJO
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BU of 7qjo by Molmil
Crystal structure of a cutinase enzyme from Marinactinospora thermotolerans DSM45154 (606)
分子名称: Cutinase
著者Zahn, M, Shakespeare, T.J, Beckham, G.T, McGeehan, J.E.
登録日2021-12-17
公開日2022-12-28
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.933 Å)
主引用文献Sourcing thermotolerant poly(ethylene terephthalate) hydrolase scaffolds from natural diversity
Nat Commun, 13, 2022
7QJS
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BU of 7qjs by Molmil
Crystal structure of a cutinase enzyme from Thermobifida fusca YX (705)
分子名称: Cutinase 2, DI(HYDROXYETHYL)ETHER, GLYCEROL, ...
著者Zahn, M, Shakespeare, T.J, Beckham, G.T, McGeehan, J.E.
登録日2021-12-17
公開日2022-12-28
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.429 Å)
主引用文献Sourcing thermotolerant poly(ethylene terephthalate) hydrolase scaffolds from natural diversity
Nat Commun, 13, 2022
1CLX
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BU of 1clx by Molmil
CATALYTIC CORE OF XYLANASE A
分子名称: CALCIUM ION, XYLANASE A
著者Harris, G.W, Jenkins, J.A, Connerton, I, Pickersgill, R.W.
登録日1995-08-31
公開日1996-06-20
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Refined crystal structure of the catalytic domain of xylanase A from Pseudomonas fluorescens at 1.8 A resolution.
Acta Crystallogr.,Sect.D, 52, 1996
6FTI
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BU of 6fti by Molmil
Cryo-EM Structure of the Mammalian Oligosaccharyltransferase Bound to Sec61 and the Programmed 80S Ribosome
分子名称: 28S rRNA, 5.8S ribosomal RNA, 5S ribosomal RNA, ...
著者Braunger, K, Becker, T, Beckmann, R.
登録日2018-02-22
公開日2018-03-21
最終更新日2020-07-29
実験手法ELECTRON MICROSCOPY (4.2 Å)
主引用文献Structural basis for coupling protein transport and N-glycosylation at the mammalian endoplasmic reticulum.
Science, 360, 2018
7UXE
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BU of 7uxe by Molmil
Pseudomonas phage E217 small terminase (TerS)
分子名称: Small terminase
著者Lokareddy, R.K, Hou, C.-F.D, Doll, S.G, Li, F, Gillilan, R, Forti, F, Briani, F, Cingolani, G.
登録日2022-05-05
公開日2022-09-28
最終更新日2024-06-12
実験手法ELECTRON MICROSCOPY (3.38 Å)
主引用文献Terminase Subunits from the Pseudomonas-Phage E217.
J.Mol.Biol., 434, 2022
6FTJ
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Cryo-EM Structure of the Mammalian Oligosaccharyltransferase Bound to Sec61 and the Non-programmed 80S Ribosome
分子名称: 28S rRNA, 5.8S ribosomal RNA, 5S ribosomal RNA, ...
著者Braunger, K, Becker, T, Beckmann, R.
登録日2018-02-22
公開日2018-03-21
最終更新日2020-07-29
実験手法ELECTRON MICROSCOPY (4.7 Å)
主引用文献Structural basis for coupling protein transport and N-glycosylation at the mammalian endoplasmic reticulum.
Science, 360, 2018
6FTG
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BU of 6ftg by Molmil
Subtomogram average of OST-containing ribosome-translocon complexes from canine rough microsomal membranes
分子名称: 28S ribosomal RNA, 5.8S ribosomal RNA, 5S ribosomal RNA, ...
著者Pfeffer, S, Foerster, F.
登録日2018-02-22
公開日2018-03-21
最終更新日2020-07-29
実験手法ELECTRON MICROSCOPY (9.1 Å)
主引用文献Structural basis for coupling protein transport and N-glycosylation at the mammalian endoplasmic reticulum.
Science, 360, 2018

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