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9DFM
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BU of 9dfm by Molmil
Crystal structure of PrnB in complex with tryptamine
分子名称: 2-(1H-INDOL-3-YL)ETHANAMINE, GLYCEROL, PROTOPORPHYRIN IX CONTAINING FE, ...
著者Li, B, Wang, Y.
登録日2024-08-30
公開日2025-04-16
実験手法X-RAY DIFFRACTION (2.25 Å)
主引用文献Elucidating ligand interactions and small-molecule activation in the pyrrolnitrin biosynthetic enzyme PrnB.
J.Biol.Chem., 301, 2025
9EBY
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BU of 9eby by Molmil
Crystal structure of RufO in complex with MRYLH
分子名称: Cytochrome P450, GLYCEROL, MET-ARG-TYR-LEU-HIS, ...
著者Nolan, K, Wang, Y.
登録日2024-11-13
公開日2025-06-18
最終更新日2025-07-09
実験手法X-RAY DIFFRACTION (2.03 Å)
主引用文献Molecular Basis for Peptide Nitration by a Novel Cytochrome P450 Enzyme in RiPP Biosynthesis.
Acs Catalysis, 15, 2025
9DUJ
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BU of 9duj by Molmil
Crystal structure of RufO in complex with (Nle)RYLH
分子名称: ACETATE ION, CHLORIDE ION, Cytochrome P450, ...
著者Nolan, K, Wang, Y.
登録日2024-10-03
公開日2025-06-18
最終更新日2025-07-09
実験手法X-RAY DIFFRACTION (1.51 Å)
主引用文献Molecular Basis for Peptide Nitration by a Novel Cytochrome P450 Enzyme in RiPP Biosynthesis.
Acs Catalysis, 15, 2025
4IFT
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BU of 4ift by Molmil
Crystal structure of double mutant thermostable NPPase from Geobacillus stearothermophilus
分子名称: Thermostable NPPase
著者Guo, Z, Huang, J, Wang, F, Qiu, R, Wang, Y, Ji, C.
登録日2012-12-15
公開日2013-12-18
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.995 Å)
主引用文献Crystal structure of thermostable NPPase from Geobacillus stearothermophilus
To be Published
1FF7
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BU of 1ff7 by Molmil
THE FIRST EGF-LIKE DOMAIN FROM HUMAN BLOOD COAGULATION FVII (FUCOSYLATED AT SER-60), NMR, 20 STRUCTURES
分子名称: PROTEIN (Blood Coagulation Factor VII), alpha-L-fucopyranose
著者Kao, Y.-H, Lee, G.F, Wang, Y, Starovasnik, M.A, Kelley, R.F, Spellman, M.W, Lerner, L.
登録日1999-02-19
公開日1999-06-16
最終更新日2024-10-16
実験手法SOLUTION NMR
主引用文献The effect of O-fucosylation on the first EGF-like domain from human blood coagulation factor VII.
Biochemistry, 38, 1999
6O5M
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BU of 6o5m by Molmil
Tubulin-RB3_SLD-TTL in complex with compound 10bb
分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CALCIUM ION, GLYCEROL, ...
著者Kumar, G, Wang, Y, Li, W, White, S.W.
登録日2019-03-04
公開日2019-07-10
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Structure-Guided Design, Synthesis, and Biological Evaluation of (2-(1H-Indol-3-yl)-1H-imidazol-4-yl)(3,4,5-trimethoxyphenyl) Methanone (ABI-231) Analogues Targeting the Colchicine Binding Site in Tubulin.
J.Med.Chem., 62, 2019
6O5N
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BU of 6o5n by Molmil
Tubulin-RB3_SLD-TTL in complex with compound 10ab
分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CALCIUM ION, GUANOSINE-5'-DIPHOSPHATE, ...
著者Kumar, G, Wang, Y, Li, W, White, S.W.
登録日2019-03-04
公開日2019-07-10
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (3.003 Å)
主引用文献Structure-Guided Design, Synthesis, and Biological Evaluation of (2-(1H-Indol-3-yl)-1H-imidazol-4-yl)(3,4,5-trimethoxyphenyl) Methanone (ABI-231) Analogues Targeting the Colchicine Binding Site in Tubulin.
J.Med.Chem., 62, 2019
4RL1
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BU of 4rl1 by Molmil
Structural and functional analysis of a loading acyltransferase from the avermectin modular polyketide synthase
分子名称: Type I polyketide synthase AVES 1
著者Wang, F, Wang, Y, Zheng, J.
登録日2014-10-15
公開日2015-01-28
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Structural and functional analysis of the loading acyltransferase from avermectin modular polyketide synthase.
Acs Chem.Biol., 10, 2015
1FFM
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BU of 1ffm by Molmil
THE FIRST EGF-LIKE DOMAIN FROM HUMAN BLOOD COAGULATION FVII (FUCOSYLATED AT SER-60), NMR, MINIMIZED AVERAGE STRUCTURE
分子名称: PROTEIN (Blood Coagulation Factor VII), alpha-L-fucopyranose
著者Kao, Y.-H, Lee, G.F, Wang, Y, Starovasnik, M.A, Kelley, R.F, Spellman, M.W, Lerner, L.
登録日1999-02-19
公開日1999-06-16
最終更新日2024-11-13
実験手法SOLUTION NMR
主引用文献The effect of O-fucosylation on the first EGF-like domain from human blood coagulation factor VII.
Biochemistry, 38, 1999
5GON
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BU of 5gon by Molmil
Structures of a beta-lactam bridged analogue in complex with tubulin
分子名称: (3R,4R)-4-(4-methoxy-3-oxidanyl-phenyl)-3-methyl-1-(3,4,5-trimethoxyphenyl)azetidin-2-one, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CALCIUM ION, ...
著者Zhou, L, Liu, Y, Cheng, L, Wang, Y.
登録日2016-07-28
公開日2017-03-22
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (2.48 Å)
主引用文献Potent Antitumor Activities and Structure Basis of the Chiral beta-Lactam Bridged Analogue of Combretastatin A-4 Binding to Tubulin.
J. Med. Chem., 59, 2016
1F7M
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BU of 1f7m by Molmil
THE FIRST EGF-LIKE DOMAIN FROM HUMAN BLOOD COAGULATION FVII, NMR, MINIMIZED AVERAGE STRUCTURE
分子名称: PROTEIN (Blood Coagulation Factor VII)
著者Kao, Y.-H, Lee, G.F, Wang, Y, Starovasnik, M.A, Kelley, R.F, Spellman, M.W, Lerner, L.
登録日1999-02-19
公開日1999-06-16
最終更新日2024-11-13
実験手法SOLUTION NMR
主引用文献The effect of O-fucosylation on the first EGF-like domain from human blood coagulation factor VII.
Biochemistry, 38, 1999
1F7E
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BU of 1f7e by Molmil
THE FIRST EGF-LIKE DOMAIN FROM HUMAN BLOOD COAGULATION FVII, NMR, 20 STRUCTURES
分子名称: PROTEIN (Blood Coagulation Factor VII)
著者Kao, Y.-H, Lee, G.F, Wang, Y, Starovasnik, M.A, Kelley, R.F, Spellman, M.W, Lerner, L.
登録日1999-02-19
公開日1999-06-16
最終更新日2024-10-30
実験手法SOLUTION NMR
主引用文献The effect of O-fucosylation on the first EGF-like domain from human blood coagulation factor VII.
Biochemistry, 38, 1999
5UY8
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BU of 5uy8 by Molmil
Crystal structure of AICARFT bound to an antifolate
分子名称: 5-[(5S)-5-ethyl-5-methyl-6-oxo-1,4,5,6-tetrahydropyridin-3-yl]-N-(6-fluoro-1-oxo-1,2-dihydroisoquinolin-7-yl)thiophene-2-sulfonamide, AMINOIMIDAZOLE 4-CARBOXAMIDE RIBONUCLEOTIDE, Bifunctional purine biosynthesis protein PURH, ...
著者Wang, J, Wang, Y, Fales, K.R, Atwell, S, Clawson, D.
登録日2017-02-23
公開日2018-01-10
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (2.39 Å)
主引用文献Discovery of N-(6-Fluoro-1-oxo-1,2-dihydroisoquinolin-7-yl)-5-[(3R)-3-hydroxypyrrolidin-1-yl]thiophene-2-sulfonamide (LSN 3213128), a Potent and Selective Nonclassical Antifolate Aminoimidazole-4-carboxamide Ribonucleotide Formyltransferase (AICARFT) Inhibitor Effective at Tumor Suppression in a Cancer Xenograft Model.
J. Med. Chem., 60, 2017
5UZ0
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BU of 5uz0 by Molmil
Crystal structure of AICARFT bound to an antifolate
分子名称: AMINOIMIDAZOLE 4-CARBOXAMIDE RIBONUCLEOTIDE, Bifunctional purine biosynthesis protein PURH, MAGNESIUM ION, ...
著者Atwell, S, Wang, Y, Fales, K.R, Clawson, D, Wang, J.
登録日2017-02-24
公開日2018-01-10
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.79 Å)
主引用文献Discovery of N-(6-Fluoro-1-oxo-1,2-dihydroisoquinolin-7-yl)-5-[(3R)-3-hydroxypyrrolidin-1-yl]thiophene-2-sulfonamide (LSN 3213128), a Potent and Selective Nonclassical Antifolate Aminoimidazole-4-carboxamide Ribonucleotide Formyltransferase (AICARFT) Inhibitor Effective at Tumor Suppression in a Cancer Xenograft Model.
J. Med. Chem., 60, 2017
6JE9
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BU of 6je9 by Molmil
Crystal structure of Nme1Cas9-sgRNA dimer mediated by double protein inhibitor AcrIIC3 monomers
分子名称: AcrIIC3, CRISPR-associated endonuclease Cas9, sgRNA
著者Sun, W, Yang, J, Cheng, Z, Liu, C, Wang, K, Huang, X, Wang, Y.
登録日2019-02-04
公開日2019-11-06
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (3.46 Å)
主引用文献Structures of Neisseria meningitidis Cas9 Complexes in Catalytically Poised and Anti-CRISPR-Inhibited States.
Mol.Cell, 76, 2019
8JFQ
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BU of 8jfq by Molmil
Structure of the Major G-Quadruplex in the Human EGFR Oncogene Promoter Adopts a Unique Folding Topology with a Distinctive Snap-back Loop
分子名称: 26mer-DNA
著者Liu, Y, Li, J, Zhang, Y, Wang, Y, Chen, J, Bian, Y, Xia, Y, Yang, M.H, Zheng, K, Wang, K.B, Kong, L.Y.
登録日2023-05-18
公開日2023-08-02
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Structure of the Major G-Quadruplex in the Human EGFR Oncogene Promoter Adopts a Unique Folding Topology with a Distinctive Snap-Back Loop.
J.Am.Chem.Soc., 145, 2023
1RE5
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BU of 1re5 by Molmil
Crystal structure of 3-carboxy-cis,cis-muconate lactonizing enzyme from Pseudomonas putida
分子名称: 2,3-DIHYDROXY-1,4-DITHIOBUTANE, 3-carboxy-cis,cis-muconate cycloisomerase, CITRIC ACID
著者Yang, J, Wang, Y, Woolridge, E.M, Petsko, G.A, Kozarich, J.W, Ringe, D.
登録日2003-11-06
公開日2004-06-08
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Crystal Structure of 3-Carboxy-cis,cis-muconate Lactonizing Enzyme from Pseudomonas putida, a Fumarase Class II Type Cycloisomerase: Enzyme Evolution in Parallel Pathways.
Biochemistry, 43, 2004
6JE4
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BU of 6je4 by Molmil
Crystal structure of Nme1Cas9-sgRNA-dsDNA dimer mediated by double protein inhibitor AcrIIC3 monomers
分子名称: 1,2-ETHANEDIOL, AcrIIC3, CRISPR-associated endonuclease Cas9, ...
著者Sun, W, Yang, J, Cheng, Z, Liu, C, Wang, K, Huang, X, Wang, Y.
登録日2019-02-04
公開日2019-11-06
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (3.069 Å)
主引用文献Structures of Neisseria meningitidis Cas9 Complexes in Catalytically Poised and Anti-CRISPR-Inhibited States.
Mol.Cell, 76, 2019
1YU8
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BU of 1yu8 by Molmil
Crystal Structure of the R37A Mutant of Villin Headpiece
分子名称: Villin
著者Meng, J, Vardar, D, Wang, Y, Guo, H.C, Head, J.F, McKnight, C.J.
登録日2005-02-12
公開日2005-09-06
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (1.45 Å)
主引用文献High-resolution crystal structures of villin headpiece and mutants with reduced F-actin binding activity.
Biochemistry, 44, 2005
1QJL
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BU of 1qjl by Molmil
METALLOTHIONEIN MTA FROM SEA URCHIN (BETA DOMAIN)
分子名称: CADMIUM ION, METALLOTHIONEIN
著者Riek, R, Precheur, B, Wang, Y, Mackay, E.A, Wider, G, Guntert, P, Liu, A, Kaegi, J.H.R, Wuthrich, K.
登録日1999-06-24
公開日1999-08-31
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献NMR structure of the sea urchin (Strongylocentrotus purpuratus) metallothionein MTA.
J. Mol. Biol., 291, 1999
1QJK
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BU of 1qjk by Molmil
Metallothionein MTA from sea urchin (alpha domain)
分子名称: CADMIUM ION, METALLOTHIONEIN
著者Riek, R, Precheur, B, Wang, Y, Mackay, E.A, Wider, G, Guntert, P, Liu, A, Kaegi, J.H.R, Wuthrich, K.
登録日1999-06-24
公開日1999-08-31
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献NMR structure of the sea urchin (Strongylocentrotus purpuratus) metallothionein MTA.
J. Mol. Biol., 291, 1999
6JFU
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BU of 6jfu by Molmil
Crystal structure of Nme2Cas9 in complex with sgRNA and target DNA (AGGCCC PAM)
分子名称: 1,2-ETHANEDIOL, CRISPR-associated endonuclease Cas9, non-target strand, ...
著者Sun, W, Yang, J, Cheng, Z, Liu, C, Wang, K, Huang, X, Wang, Y.
登録日2019-02-12
公開日2019-11-06
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (3.2 Å)
主引用文献Structures of Neisseria meningitidis Cas9 Complexes in Catalytically Poised and Anti-CRISPR-Inhibited States.
Mol.Cell, 76, 2019
2B5F
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BU of 2b5f by Molmil
Crystal structure of the spinach aquaporin SoPIP2;1 in an open conformation to 3.9 resolution
分子名称: aquaporin
著者Tornroth-Horsefield, S, Wang, Y, Hedfalk, K, Johanson, U, Karlsson, M, Tajkhorshid, E, Neutze, R, Kjellbom, P.
登録日2005-09-28
公開日2005-12-20
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (3.9 Å)
主引用文献Structural mechanism of plant aquaporin gating
Nature, 439, 2006
8SNL
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BU of 8snl by Molmil
Structure of human ADAM17/iRhom2 sheddase complex
分子名称: CALCIUM ION, Disintegrin and metalloproteinase domain-containing protein 17, Inactive rhomboid protein 2, ...
著者Zhao, H, Dai, Y, Wang, Y, Lee, C.H.
登録日2023-04-27
公開日2024-05-29
最終更新日2024-12-11
実験手法ELECTRON MICROSCOPY (2.78 Å)
主引用文献Cryo-EM reveals that iRhom2 restrains ADAM17 protease activity to control the release of growth factor and inflammatory signals.
Mol.Cell, 84, 2024
8SNO
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BU of 8sno by Molmil
Structure of mature human ADAM17/iRhom2 sheddase complex, conformation 2
分子名称: CALCIUM ION, Disintegrin and metalloproteinase domain-containing protein 17, Inactive rhomboid protein 2
著者Zhao, H, Dai, Y, Wang, Y, Lee, C.H.
登録日2023-04-27
公開日2024-05-29
最終更新日2024-12-11
実験手法ELECTRON MICROSCOPY (2.78 Å)
主引用文献Cryo-EM reveals that iRhom2 restrains ADAM17 protease activity to control the release of growth factor and inflammatory signals.
Mol.Cell, 84, 2024

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