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4NV0
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Crystal structure of cytosolic 5'-nucleotidase IIIB (cN-IIIB) bound to 7-methylguanosine
分子名称: 7-METHYLGUANOSINE, 7-methylguanosine phosphate-specific 5'-nucleotidase, MAGNESIUM ION, ...
著者Monecke, T, Neumann, P, Ficner, R.
登録日2013-12-04
公開日2014-03-19
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Crystal Structures of the Novel Cytosolic 5'-Nucleotidase IIIB Explain Its Preference for m7GMP
Plos One, 9, 2014
8TO2
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Bottom cylinder of high-resolution phycobilisome quenched by OCP (local refinement)
分子名称: Allophycocyanin alpha chain, Allophycocyanin beta chain, Allophycocyanin subunit alpha-B, ...
著者Sauer, P.V, Sutter, M, Cupellini, L.
登録日2023-08-02
公開日2024-04-17
実験手法ELECTRON MICROSCOPY (2 Å)
主引用文献Structural and quantum chemical basis for OCP-mediated quenching of phycobilisomes.
Sci Adv, 10, 2024
8TWF
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Crystal structure of tetracycline destructase Tet(56-3)
分子名称: 6-hydroxynicotinate 3-monooxygenase, FLAVIN-ADENINE DINUCLEOTIDE
著者Kumar, H, Tang, W.K, Tolia, N.
登録日2023-08-21
公開日2024-07-03
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Sequence-structure-function characterization of the emerging tetracycline destructase family of antibiotic resistance enzymes.
Commun Biol, 7, 2024
8TWG
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Crystal structure of tetracycline destructase Tet(56-2)
分子名称: 6-hydroxynicotinate 3-monooxygenase, FLAVIN-ADENINE DINUCLEOTIDE
著者Kumar, H, Tang, W.K, Tolia, N.
登録日2023-08-21
公開日2024-07-03
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Sequence-structure-function characterization of the emerging tetracycline destructase family of antibiotic resistance enzymes.
Commun Biol, 7, 2024
9FBV
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70S Escherichia coli ribosome with P-site initiatior tRNA.
分子名称: 16S ribosomal RNA, 23S ribosomal RNA, 30S ribosomal protein S16, ...
著者Koller, T.O, Wilson, D.N.
登録日2024-05-14
公開日2024-06-26
実験手法ELECTRON MICROSCOPY (2.4 Å)
主引用文献Paenilamicins from the honey bee pathogen Paenibacillus larvae are context-specific translocation inhibitors of protein synthesis.
Biorxiv, 2024
8WD4
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EGFR(L858R/T790/C797S) in complex with compound 5j
分子名称: CHLORIDE ION, Epidermal growth factor receptor, ~{N}-[3,3-bis(fluoranyl)propyl]-4-[[(2~{S})-butan-2-yl]amino]-6-[[2-(1-cyclopropylsulfonylpyrazol-4-yl)pyrimidin-4-yl]amino]pyridine-3-carboxamide
著者Nishikawa, Y.
登録日2023-09-14
公開日2023-12-20
最終更新日2024-01-03
実験手法X-RAY DIFFRACTION (2.55 Å)
主引用文献Synthesis, activity, and their relationships of 2,4-diaminonicotinamide derivatives as EGFR inhibitors targeting C797S mutation.
Bioorg.Med.Chem.Lett., 98, 2023
8UK6
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Candida albicans glutaminyl tRNA synthetase (GLN4) in complex with N-pyrimidinyl-beta-thiophenylacrylamide
分子名称: (2E)-N-(pyrimidin-2-yl)-3-(thiophen-2-yl)prop-2-enamide, ZINC ION, glutamine--tRNA ligase
著者Sychantha, D, Wright, G.D.
登録日2023-10-12
公開日2024-03-06
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (2.73 Å)
主引用文献Allosteric inhibition of tRNA synthetase Gln4 by N-pyrimidinyl-beta-thiophenylacrylamides exerts highly selective antifungal activity.
Cell Chem Biol, 31, 2024
8TTM
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IgG1 Fc Heterodimer combYSelect1
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-2)-alpha-D-mannopyranose-(1-3)-[2-acetamido-2-deoxy-beta-D-glucopyranose-(1-2)-alpha-D-mannopyranose-(1-6)]beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, Immunoglobulin gamma-1 heavy chain
著者Azzam, T, Du, J.J, Sundberg, E.J.
登録日2023-08-14
公開日2024-06-26
実験手法X-RAY DIFFRACTION (2.51 Å)
主引用文献Combinatorially restricted computational design of protein-protein interfaces to produce IgG heterodimers.
Sci Adv, 10, 2024
8TUD
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IgG1 Fc Heterodimer combYSelect2
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-2)-alpha-D-mannopyranose-(1-3)-[2-acetamido-2-deoxy-beta-D-glucopyranose-(1-2)-alpha-D-mannopyranose-(1-6)]beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, Immunoglobulin gamma-1 heavy chain
著者Azzam, T, Du, J.J, Sundberg, E.J.
登録日2023-08-16
公開日2024-06-26
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献Combinatorially restricted computational design of protein-protein interfaces to produce IgG heterodimers.
Sci Adv, 10, 2024
8VFU
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BU of 8vfu by Molmil
The Fab Crystal Structure of the PAN IL-1 Family Inhibitor Antibody 3G5
分子名称: 3G5 Heavy Chain, 3G5 Light Chain
著者Fields, J.K, Sundberg, E.J.
登録日2023-12-22
公開日2024-02-21
最終更新日2024-06-19
実験手法X-RAY DIFFRACTION (2.45 Å)
主引用文献Antibodies targeting the shared cytokine receptor IL-1 receptor accessory protein invoke distinct mechanisms to block all cytokine signaling.
Cell Rep, 43, 2024
8TO5
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BU of 8to5 by Molmil
Central rod disk in C1 symmetry of high-resolution phycobilisome quenched by OCP (local refinement)
分子名称: C-phycocyanin alpha subunit, C-phycocyanin beta subunit, PHYCOCYANOBILIN, ...
著者Sauer, P.V, Sutter, M, Cupellini, L.
登録日2023-08-02
公開日2024-04-17
実験手法ELECTRON MICROSCOPY (1.87 Å)
主引用文献Structural and quantum chemical basis for OCP-mediated quenching of phycobilisomes.
Sci Adv, 10, 2024
8Y6H
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P-glycoprotein in complex with UIC2 Fab and triple elacridar molecules in LMNG detergent
分子名称: ATP-dependent translocase ABCB1,mNeonGreen, UIC2 Fab heavy chain, UIC2 Fab light chain, ...
著者Hamaguchi-Suzuki, N, Adachi, N, Moriya, T, Kawasaki, M, Suzuki, K, Anzai, N, Senda, T, Murata, T.
登録日2024-02-02
公開日2024-04-17
実験手法ELECTRON MICROSCOPY (2.49 Å)
主引用文献Cryo-EM structure of P-glycoprotein bound to triple elacridar inhibitor molecules.
Biochem.Biophys.Res.Commun., 709, 2024
8W6X
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Neutron structure of [NiFe]-hydrogenase from D. vulgaris Miyazaki F in its oxidized state
分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, CHLORIDE ION, FE3-S4 CLUSTER, ...
著者Hiromoto, T, Tamada, T.
登録日2023-08-30
公開日2023-09-13
最終更新日2023-11-15
実験手法NEUTRON DIFFRACTION (1.04 Å), X-RAY DIFFRACTION
主引用文献New insights into the oxidation process from neutron and X-ray crystal structures of an O 2 -sensitive [NiFe]-hydrogenase.
Chem Sci, 14, 2023
8Y6I
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P-glycoprotein in complex with UIC2 Fab and triple elacridar molecules in nanodisc
分子名称: 1,2-Distearoyl-sn-glycerophosphoethanolamine, ATP-dependent translocase ABCB1,mNeonGreen, CHOLESTEROL, ...
著者Hamaguchi-Suzuki, N, Adachi, N, Moriya, T, Kawasaki, M, Suzuki, K, Anzai, N, Senda, T, Murata, T.
登録日2024-02-02
公開日2024-04-17
実験手法ELECTRON MICROSCOPY (2.54 Å)
主引用文献Cryo-EM structure of P-glycoprotein bound to triple elacridar inhibitor molecules.
Biochem.Biophys.Res.Commun., 709, 2024
3E9U
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BU of 3e9u by Molmil
Crystal structure of Calx CBD2 domain
分子名称: Na/Ca exchange protein
著者Wu, M, Zheng, L.
登録日2008-08-23
公開日2009-01-27
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Crystal structure of CBD2 from the Drosophila Na(+)/Ca(2+) exchanger: diversity of Ca(2+) regulation and its alternative splicing modification.
J.Mol.Biol., 387, 2009
8TRO
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BU of 8tro by Molmil
Rod from high-resolution phycobilisome quenched by OCP (local refinement)
分子名称: C-phycocyanin alpha subunit, C-phycocyanin beta subunit, PHYCOCYANOBILIN, ...
著者Sauer, P.V, Sutter, M, Cupellini, L.
登録日2023-08-09
公開日2024-04-17
実験手法ELECTRON MICROSCOPY (1.9 Å)
主引用文献Structural and quantum chemical basis for OCP-mediated quenching of phycobilisomes.
Sci Adv, 10, 2024
4HKR
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BU of 4hkr by Molmil
Calcium release-activated calcium (CRAC) channel ORAI
分子名称: BARIUM ION, Calcium release-activated calcium channel protein 1, FE (III) ION, ...
著者Long, S.B, Hou, X.
登録日2012-10-15
公開日2012-11-28
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (3.3511 Å)
主引用文献Crystal structure of the calcium release-activated calcium channel Orai.
Science, 338, 2012
4HKS
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BU of 4hks by Molmil
Calcium release-activated calcium (CRAC) channel ORAI, K163W mutant
分子名称: CALCIUM ION, Calcium release-activated calcium channel protein 1, ZINC ION
著者Long, S.B, Hou, X.
登録日2012-10-15
公開日2012-11-28
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (3.3516 Å)
主引用文献Crystal structure of the calcium release-activated calcium channel Orai.
Science, 338, 2012
8IXS
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BU of 8ixs by Molmil
Methyl and Fluorine Effects in Novel Orally Bioavailable Keap1/Nrf2 PPI Inhibitor for Treatment of Chronic Kidney Disease
分子名称: (2R,3S)-3-[[(2S)-2-fluoranyl-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanoyl]amino]-2-methyl-3-(4-methylphenyl)propanoic acid, Kelch-like ECH-associated protein 1, SULFATE ION
著者Nomura, A, Yamaguchi, K, Adachi, T.
登録日2023-04-03
公開日2023-06-14
最終更新日2024-05-29
実験手法X-RAY DIFFRACTION (1.48 Å)
主引用文献Methyl and Fluorine Effects in Novel Orally Bioavailable Keap1-Nrf2 PPI Inhibitor.
Acs Med.Chem.Lett., 14, 2023
8IVR
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BU of 8ivr by Molmil
Methyl and Fluorine Effects in Novel Orally Bioavailable Keap1/Nrf2 PPI Inhibitor for Treatment of Chronic Kidney Disease
分子名称: (2R,3S)-2-methyl-3-(4-methylphenyl)-3-[2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanoylamino]propanoic acid, Kelch-like ECH-associated protein 1, SULFATE ION
著者Nomura, A, Yamaguchi, K, Adachi, T.
登録日2023-03-28
公開日2023-06-14
最終更新日2024-05-29
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Methyl and Fluorine Effects in Novel Orally Bioavailable Keap1-Nrf2 PPI Inhibitor.
Acs Med.Chem.Lett., 14, 2023
8IVW
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Crystal structure of NRP2 in complex with aNRP2-10 Fab fragment
分子名称: Heavy chian of antibody 10V8 Fab fragment, Light chain of antibody 10V8 Fab fragment, Neuropilin-2
著者Geng, Y, Zhai, L.
登録日2023-03-29
公開日2023-07-12
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (3.205 Å)
主引用文献Inhibition of VEGF binding to neuropilin-2 enhances chemosensitivity and inhibits metastasis in triple-negative breast cancer.
Sci Transl Med, 15, 2023
8IVX
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BU of 8ivx by Molmil
Crystal structure of NRP2 in complex with aNRP2-14 Fab fragment
分子名称: 1,2-ETHANEDIOL, Heavy chain of antibody 14V4 Fab fragment, Light chain of antibody 14V4 Fab fragment, ...
著者Geng, Y, Zhai, L.
登録日2023-03-29
公開日2023-07-12
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Inhibition of VEGF binding to neuropilin-2 enhances chemosensitivity and inhibits metastasis in triple-negative breast cancer.
Sci Transl Med, 15, 2023
8JHU
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BU of 8jhu by Molmil
Legionella effector protein SidI
分子名称: Legionella pneumophila effector protein SidI
著者Wang, L, Subramanian, A, Mukherjee, S, Walter, P.
登録日2023-05-25
公開日2023-08-30
最終更新日2024-05-08
実験手法ELECTRON MICROSCOPY (3.1 Å)
主引用文献A Legionella toxin exhibits tRNA mimicry and glycosyl transferase activity to target the translation machinery and trigger a ribotoxic stress response.
Nat.Cell Biol., 25, 2023
6J6U
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Rat PTPRZ D1-D2 domain
分子名称: Receptor-type tyrosine-protein phosphatase zeta
著者Sugawara, H.
登録日2019-01-15
公開日2019-08-28
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (3.32 Å)
主引用文献A head-to-toe dimerization has physiological relevance for ligand-induced inactivation of protein tyrosine receptor type Z.
J.Biol.Chem., 294, 2019
7L4U
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BU of 7l4u by Molmil
Crystal structure of human monoacylglycerol lipase in complex with compound 1h
分子名称: (5S)-5-(3-{4-[(2-chloro-4-fluorophenoxy)methyl]piperidin-1-yl}-3-oxopropyl)pyrrolidin-2-one, CHLORIDE ION, Monoglyceride lipase
著者Qin, L, Lane, W, Skene, R.J, Dougan, D.
登録日2020-12-21
公開日2021-08-11
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.25 Å)
主引用文献Design and Synthesis of Novel Spiro Derivatives as Potent and Reversible Monoacylglycerol Lipase (MAGL) Inhibitors: Bioisosteric Transformation from 3-Oxo-3,4-dihydro-2 H -benzo[ b ][1,4]oxazin-6-yl Moiety.
J.Med.Chem., 64, 2021

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