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6JG5
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BU of 6jg5 by Molmil
Crystal structure of AimR
分子名称: AimR transcriptional regulator
著者Guan, Z.Y, Pei, K, Zou, T.T.
登録日2019-02-13
公開日2019-07-03
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.221 Å)
主引用文献Structural insights into DNA recognition by AimR of the arbitrium communication system in the SPbeta phage.
Cell Discov, 5, 2019
5ZVV
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Structure of SeMet-phAimR
分子名称: AimR transcriptional regulator, GLYCEROL
著者Cheng, W, Dou, C.
登録日2018-05-13
公開日2018-09-05
最終更新日2019-03-13
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Structural and functional insights into the regulation of the lysis-lysogeny decision in viral communities.
Nat Microbiol, 3, 2018
5ZW6
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BU of 5zw6 by Molmil
Structure of spAimR
分子名称: AimR transcriptional regulator, GLY-MET-PRO-ARG-GLY-ALA
著者Cheng, W, Dou, C.
登録日2018-05-14
公開日2018-09-05
最終更新日2024-03-27
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Structural and functional insights into the regulation of the lysis-lysogeny decision in viral communities.
Nat Microbiol, 3, 2018
5ZW5
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Structure of SeMet-spAimR
分子名称: AimR transcriptional regulator
著者Cheng, W, Dou, C.
登録日2018-05-14
公開日2018-08-29
最終更新日2019-03-13
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Structural and functional insights into the regulation of the lysis-lysogeny decision in viral communities.
Nat Microbiol, 3, 2018
5ZVW
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BU of 5zvw by Molmil
Structure of phAimR-Ligand
分子名称: AimR transcriptional regulator, SER-ALA-ILE-ARG-GLY-ALA
著者Cheng, W, Dou, C.
登録日2018-05-13
公開日2018-09-05
最終更新日2024-03-27
実験手法X-RAY DIFFRACTION (2.292 Å)
主引用文献Structural and functional insights into the regulation of the lysis-lysogeny decision in viral communities.
Nat Microbiol, 3, 2018
4QGE
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phosphodiesterase-9A in complex with inhibitor WYQ-C36D
分子名称: MAGNESIUM ION, N~2~-(1-cyclopentyl-4-oxo-4,7-dihydro-1H-pyrazolo[3,4-d]pyrimidin-6-yl)-N-(4-methoxyphenyl)-D-alaninamide, Phosphodiesterase 9A, ...
著者Shao, Y.-X, Huang, M, Cui, W, Ke, H.
登録日2014-05-22
公開日2014-12-10
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Discovery of a Phosphodiesterase 9A Inhibitor as a Potential Hypoglycemic Agent.
J.Med.Chem., 57, 2014
7KSG
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BU of 7ksg by Molmil
SARS-CoV-2 spike in complex with nanobodies E
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, Nanobody against SARS-CoV-2 glycoprotein, Spike glycoprotein
著者Hallberg, B.M, Das, H.
登録日2020-11-22
公開日2021-01-20
最終更新日2021-06-30
実験手法ELECTRON MICROSCOPY (3.33 Å)
主引用文献Structure-guided multivalent nanobodies block SARS-CoV-2 infection and suppress mutational escape.
Science, 371, 2021
7KHL
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BU of 7khl by Molmil
BRD4-BD1 Compound6 (methyl 4-(3,5-difluoropyridin-2-yl)-10-methyl-7-((methylsulfonyl)methyl)-11-oxo-3,4,10,11-tetrahydro-1H-1,4,10-triazadibenzo[cd,f]azulene-6-carboxylate)
分子名称: Bromodomain-containing protein 4, GLYCEROL, methyl 7-(3,5-difluoropyridin-2-yl)-2-methyl-10-[(methylsulfonyl)methyl]-3-oxo-3,4,6,7-tetrahydro-2H-2,4,7-triazadibenzo[cd,f]azulene-9-carboxylate
著者Murray, J.M.
登録日2020-10-21
公開日2021-02-24
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.286 Å)
主引用文献Antibody-Mediated Delivery of Chimeric BRD4 Degraders. Part 2: Improvement of In Vitro Antiproliferation Activity and In Vivo Antitumor Efficacy.
J.Med.Chem., 64, 2021
7KHH
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Ternary complex of VHL/BRD4-BD1/Compound9 (4-(3,5-difluoropyridin-2-yl)-N-(11-(((S)-1-((2S,4R)-4-hydroxy-2-((4-(4-methylthiazol-5-yl)benzyl)carbamoyl)pyrrolidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl)amino)-11-oxoundecyl)-10-methyl-7-((methylsulfonyl)methyl)-11-oxo-3,4,10,11-tetrahydro-1H-1,4,10-triazadibenzo[cd,f]azulene-6-carboxamide)
分子名称: Bromodomain-containing protein 4, Elongin-B, Elongin-C, ...
著者Murray, J.M.
登録日2020-10-21
公開日2021-02-24
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.281 Å)
主引用文献Antibody-Mediated Delivery of Chimeric BRD4 Degraders. Part 2: Improvement of In Vitro Antiproliferation Activity and In Vivo Antitumor Efficacy.
J.Med.Chem., 64, 2021
7KXL
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BTK1 SOAKED WITH COMPOUND 5, Y551 IS SEQUESTERED
分子名称: 3-tert-butyl-N-({2-fluoro-4-[2-(1-methyl-1H-pyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]phenyl}methyl)-1,2,4-oxadiazole-5-carboxamide, DIMETHYL SULFOXIDE, Tyrosine-protein kinase BTK
著者Gardberg, A.
登録日2020-12-04
公開日2021-05-19
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.84 Å)
主引用文献Discovery of potent and selective reversible Bruton's tyrosine kinase inhibitors.
Bioorg.Med.Chem., 40, 2021
7KXP
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BTK1 SOAKED WITH COMPOUND 25
分子名称: 3-tert-butyl-N-[(1S)-6-{2-[3-methyl-1-(oxan-4-yl)-1H-pyrazol-4-yl]-1H-imidazo[4,5-b]pyridin-7-yl}-1,2,3,4-tetrahydronaphthalen-1-yl]-1,2,4-oxadiazole-5-carboxamide, DIMETHYL SULFOXIDE, Tyrosine-protein kinase BTK
著者Viacava Follis, A.
登録日2020-12-04
公開日2021-05-19
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.83 Å)
主引用文献Discovery of potent and selective reversible Bruton's tyrosine kinase inhibitors.
Bioorg.Med.Chem., 40, 2021
7KXO
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BTK1 SOAKED WITH COMPOUND 24
分子名称: 3-tert-butyl-N-[(1R)-6-{2-[5-methyl-1-(oxan-4-yl)-1H-pyrazol-4-yl]-3H-imidazo[4,5-b]pyridin-7-yl}-1,2,3,4-tetrahydronaphthalen-1-yl]-1,2,4-oxadiazole-5-carboxamide, DIMETHYL SULFOXIDE, Isoform BTK-C of Tyrosine-protein kinase BTK
著者Viacava Follis, A.
登録日2020-12-04
公開日2021-05-19
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.94 Å)
主引用文献Discovery of potent and selective reversible Bruton's tyrosine kinase inhibitors.
Bioorg.Med.Chem., 40, 2021
7KXM
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BTK1 SOAKED WITH COMPOUND 5, Y551 IS SEQUESTERED
分子名称: 4-tert-butyl-N-(2-methyl-3-{2-[4-(morpholine-4-carbonyl)phenyl]-1H-imidazo[4,5-b]pyridin-7-yl}phenyl)benzamide, Tyrosine-protein kinase BTK
著者Gardberg, A.
登録日2020-12-04
公開日2021-05-19
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.33 Å)
主引用文献Discovery of potent and selective reversible Bruton's tyrosine kinase inhibitors.
Bioorg.Med.Chem., 40, 2021
7KXN
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BTK1 SOAKED WITH COMPOUND 26
分子名称: 3-tert-butyl-N-[(1S)-6-{2-[5-methyl-1-(propan-2-yl)-1H-pyrazol-4-yl]-1H-imidazo[4,5-b]pyridin-7-yl}-1,2,3,4-tetrahydronaphthalen-1-yl]-1,2,4-oxadiazole-5-carboxamide, DIMETHYL SULFOXIDE, Isoform BTK-C of Tyrosine-protein kinase BTK
著者Viacava Follis, A.
登録日2020-12-04
公開日2021-05-19
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.34 Å)
主引用文献Discovery of potent and selective reversible Bruton's tyrosine kinase inhibitors.
Bioorg.Med.Chem., 40, 2021
7KXQ
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BTK1 SOAKED WITH COMPOUND 30
分子名称: 3-tert-butyl-N-[(5R)-2-{2-[3,5-dimethyl-1-(propan-2-yl)-1H-pyrazol-4-yl]-3H-imidazo[4,5-b]pyridin-7-yl}-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-yl]-1,2,4-oxadiazole-5-carboxamide, DIMETHYL SULFOXIDE, Isoform BTK-C of Tyrosine-protein kinase BTK
著者Viacava Follis, A.
登録日2020-12-04
公開日2021-05-19
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.38 Å)
主引用文献Discovery of potent and selective reversible Bruton's tyrosine kinase inhibitors.
Bioorg.Med.Chem., 40, 2021
2AFG
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BU of 2afg by Molmil
2.0 ANGSTROM X-RAY STRUCTURE OF HUMAN ACIDIC FIBROBLAST GROWTH FACTOR
分子名称: ACIDIC FIBROBLAST GROWTH FACTOR, SULFATE ION
著者Blaber, M, Disalvo, J, Thomas, K.A.
登録日1995-07-21
公開日1995-10-15
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献X-ray crystal structure of human acidic fibroblast growth factor.
Biochemistry, 35, 1996
2AXM
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HEPARIN-LINKED BIOLOGICALLY-ACTIVE DIMER OF FIBROBLAST GROWTH FACTOR
分子名称: 2-O-sulfo-alpha-L-idopyranuronic acid-(1-4)-2-deoxy-6-O-sulfo-2-(sulfoamino)-alpha-D-glucopyranose-(1-4)-2-O-sulfo-alpha-L-idopyranuronic acid-(1-4)-2-deoxy-6-O-sulfo-2-(sulfoamino)-alpha-D-glucopyranose-(1-4)-2-O-sulfo-alpha-L-idopyranuronic acid-(1-4)-2-deoxy-6-O-sulfo-2-(sulfoamino)-alpha-D-glucopyranose, ACIDIC FIBROBLAST GROWTH FACTOR
著者Digabriele, A.D, Lax, I, Chen, D.I, Svahn, C.M, Jaye, M, Schlessinger, J, Hendrickson, W.A.
登録日1997-10-20
公開日1998-04-22
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献Structure of a heparin-linked biologically active dimer of fibroblast growth factor.
Nature, 393, 1998
7DMP
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BU of 7dmp by Molmil
Mouse radial spoke complex
分子名称: Radial spoke head 1 homolog, Radial spoke head protein 4 homolog A, Radial spoke head protein 9 homolog
著者Zheng, W, Cong, Y.
登録日2020-12-05
公開日2021-07-21
最終更新日2024-03-27
実験手法ELECTRON MICROSCOPY (3.2 Å)
主引用文献Distinct architecture and composition of mouse axonemal radial spoke head revealed by cryo-EM
Proc.Natl.Acad.Sci.USA, 118, 2021
1BFB
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BU of 1bfb by Molmil
BASIC FIBROBLAST GROWTH FACTOR COMPLEXED WITH HEPARIN TETRAMER FRAGMENT
分子名称: 4-deoxy-2-O-sulfo-alpha-L-threo-hex-4-enopyranuronic acid-(1-4)-2-deoxy-6-O-sulfo-2-(sulfoamino)-alpha-D-glucopyranose-(1-4)-2-O-sulfo-alpha-L-idopyranuronic acid-(1-4)-2-deoxy-6-O-sulfo-2-(sulfoamino)-alpha-D-glucopyranose, BASIC FIBROBLAST GROWTH FACTOR
著者Faham, S, Rees, D.C.
登録日1995-12-12
公開日1996-04-03
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Heparin structure and interactions with basic fibroblast growth factor.
Science, 271, 1996
8FF2
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Amyloid-beta (1-40) fibrils derived from a CAA patient
分子名称: Amyloid-beta precursor protein
著者Crooks, E.J, Fu, Z, Chowdhury, S, Smith, S.O.
登録日2022-12-07
公開日2023-12-06
最終更新日2024-05-01
実験手法ELECTRON MICROSCOPY (2.87 Å)
主引用文献An electrostatic cluster guides A beta 40 fibril formation in sporadic and Dutch-type cerebral amyloid angiopathy.
J.Struct.Biol., 216, 2024
8FF3
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Amyloid-beta (1-40) fibrils derived from familial Dutch-type CAA patient (population B)
分子名称: Amyloid-beta precursor protein
著者Crooks, E.J, Fu, Z, Chowdury, S, Smith, S.O.
登録日2022-12-07
公開日2023-12-06
最終更新日2024-05-01
実験手法ELECTRON MICROSCOPY (3.09 Å)
主引用文献An electrostatic cluster guides A beta 40 fibril formation in sporadic and Dutch-type cerebral amyloid angiopathy.
J.Struct.Biol., 216, 2024
8H0B
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Structure of the thermolabile hemolysin from Vibrio alginolyticus (in complex with oleic acid)
分子名称: MAGNESIUM ION, OLEIC ACID, PENTAETHYLENE GLYCOL, ...
著者Ma, Q, Wang, C.
登録日2022-09-28
公開日2023-08-16
実験手法X-RAY DIFFRACTION (1.931 Å)
主引用文献Catalytic site flexibility facilitates the substrate and catalytic promiscuity of Vibrio dual lipase/transferase.
Nat Commun, 14, 2023
8H0A
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Structure of the thermolabile hemolysin from Vibrio alginolyticus (in complex with lauric acid)
分子名称: DI(HYDROXYETHYL)ETHER, LAURIC ACID, MAGNESIUM ION, ...
著者Ma, Q, Wang, C.
登録日2022-09-28
公開日2023-08-16
実験手法X-RAY DIFFRACTION (1.94 Å)
主引用文献Catalytic site flexibility facilitates the substrate and catalytic promiscuity of Vibrio dual lipase/transferase.
Nat Commun, 14, 2023
8H09
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Structure of the thermolabile hemolysin from Vibrio alginolyticus (apo form)
分子名称: 3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE, DI(HYDROXYETHYL)ETHER, MAGNESIUM ION, ...
著者Ma, Q, Wang, C.
登録日2022-09-28
公開日2023-08-16
実験手法X-RAY DIFFRACTION (1.81 Å)
主引用文献Catalytic site flexibility facilitates the substrate and catalytic promiscuity of Vibrio dual lipase/transferase.
Nat Commun, 14, 2023
8H0D
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Structure of the thermolabile hemolysin from Vibrio alginolyticus (in complex with docosahexaenoic acid)
分子名称: 3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE, DOCOSA-4,7,10,13,16,19-HEXAENOIC ACID, MAGNESIUM ION, ...
著者Ma, Q, Wang, C.
登録日2022-09-28
公開日2023-08-16
実験手法X-RAY DIFFRACTION (2.01 Å)
主引用文献Catalytic site flexibility facilitates the substrate and catalytic promiscuity of Vibrio dual lipase/transferase.
Nat Commun, 14, 2023

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