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6ACB
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BU of 6acb by Molmil
Crystal structure of PDE5 in complex with inhibitor LW1805
分子名称: 3-[(2H-1,3-benzodioxol-5-yl)methyl]-8-fluoro-6-{[2-(4-methylpiperazin-1-yl)ethyl]amino}-1-(1,3-thiazol-2-yl)[1]benzopyrano[2,3-c]pyrrol-9(2H)-one, MAGNESIUM ION, SULFATE ION, ...
著者Wu, D, Huang, Y.D, Huang, Y.Y, Luo, H.B.
登録日2018-07-26
公開日2018-09-19
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Optimization of Chromeno[2,3- c]pyrrol-9(2 H)-ones as Highly Potent, Selective, and Orally Bioavailable PDE5 Inhibitors: Structure-Activity Relationship, X-ray Crystal Structure, and Pharmacodynamic Effect on Pulmonary Arterial Hypertension.
J. Med. Chem., 61, 2018
4DNV
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BU of 4dnv by Molmil
Crystal structure of the W285F mutant of UVB-resistance protein UVR8
分子名称: AT5g63860/MGI19_6
著者Wu, D, Hu, Q, Yan, Z, Chen, W, Yan, C, Zhang, J, Wang, J, Shi, Y.
登録日2012-02-09
公開日2012-03-07
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.999 Å)
主引用文献Structural basis of ultraviolet-B perception by UVR8.
Nature, 484, 2012
4DNU
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BU of 4dnu by Molmil
Crystal structure of the W285A mutant of UVB-resistance protein UVR8
分子名称: AT5g63860/MGI19_6
著者Wu, D, Hu, Q, Yan, Z, Chen, W, Yan, C, Zhang, J, Wang, J, Shi, Y.
登録日2012-02-09
公開日2012-03-07
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (1.764 Å)
主引用文献Structural basis of ultraviolet-B perception by UVR8.
Nature, 484, 2012
7XBK
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BU of 7xbk by Molmil
Structure and mechanism of a mitochondrial AAA+ disaggregase CLPB
分子名称: ADENOSINE-5'-TRIPHOSPHATE, Isoform 2 of Caseinolytic peptidase B protein homolog, MAGNESIUM ION, ...
著者Wu, D, Liu, Y, Dai, Y, Wang, G, Lu, G, Chen, Y, Li, N, Lin, J, Gao, N.
登録日2022-03-21
公開日2023-01-25
最終更新日2024-06-26
実験手法ELECTRON MICROSCOPY (3.7 Å)
主引用文献Comprehensive structural characterization of the human AAA+ disaggregase CLPB in the apo- and substrate-bound states reveals a unique mode of action driven by oligomerization.
Plos Biol., 21, 2023
5SY5
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BU of 5sy5 by Molmil
Crystal Structure of the Heterodimeric NPAS1-ARNT Complex
分子名称: Aryl hydrocarbon receptor nuclear translocator, Neuronal PAS domain-containing protein 1
著者Wu, D, Su, X, Potluri, N, Kim, Y, Rastinejad, F.
登録日2016-08-10
公開日2016-11-09
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (3.201 Å)
主引用文献NPAS1-ARNT and NPAS3-ARNT crystal structures implicate the bHLH-PAS family as multi-ligand binding transcription factors.
Elife, 5, 2016
5SY7
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BU of 5sy7 by Molmil
Crystal Structure of the Heterodimeric NPAS3-ARNT Complex with HRE DNA
分子名称: Aryl hydrocarbon receptor nuclear translocator, DNA (5'-D(*CP*AP*CP*GP*AP*CP*CP*CP*GP*CP*AP*CP*GP*TP*AP*CP*GP*CP*AP*GP*C)-3'), DNA (5'-D(*GP*GP*CP*TP*GP*CP*GP*TP*AP*CP*GP*TP*GP*CP*GP*GP*GP*TP*CP*GP*T)-3'), ...
著者Wu, D, Su, X, Potluri, N, Kim, Y, Rastinejad, F.
登録日2016-08-10
公開日2016-11-09
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (4.2 Å)
主引用文献NPAS1-ARNT and NPAS3-ARNT crystal structures implicate the bHLH-PAS family as multi-ligand binding transcription factors.
Elife, 5, 2016
8JSX
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BU of 8jsx by Molmil
VMAT2 complex with noradrenaline in lumen-facing state
分子名称: Noradrenaline, Synaptic vesicular amine transporter
著者Jiang, D.H, Wu, D.
登録日2023-06-20
公開日2024-05-08
最終更新日2025-07-02
実験手法ELECTRON MICROSCOPY (3.16 Å)
主引用文献Structural snapshots of human VMAT2 reveal insights into substrate recognition and proton coupling mechanism.
Cell Res., 34, 2024
8JTB
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BU of 8jtb by Molmil
VMAT2 complex with dopamine
分子名称: L-DOPAMINE, Synaptic vesicular amine transporter
著者Jiang, D.H, Wu, D.
登録日2023-06-21
公開日2024-05-08
最終更新日2025-07-02
実験手法ELECTRON MICROSCOPY (2.93 Å)
主引用文献Structural snapshots of human VMAT2 reveal insights into substrate recognition and proton coupling mechanism.
Cell Res., 34, 2024
8JT5
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BU of 8jt5 by Molmil
VMAT2 complex with histamine
分子名称: HISTAMINE, Synaptic vesicular amine transporter
著者Jiang, D.H, Wu, D.
登録日2023-06-21
公開日2024-05-08
最終更新日2025-06-25
実験手法ELECTRON MICROSCOPY (3.06 Å)
主引用文献Structural snapshots of human VMAT2 reveal insights into substrate recognition and proton coupling mechanism.
Cell Res., 34, 2024
8JSW
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BU of 8jsw by Molmil
Human VMAT2 complex with serotonin
分子名称: SEROTONIN, Synaptic vesicular amine transporter
著者Jiang, D.H, Wu, D.
登録日2023-06-20
公開日2023-11-29
最終更新日2025-06-25
実験手法ELECTRON MICROSCOPY (2.84 Å)
主引用文献Transport and inhibition mechanisms of human VMAT2.
Nature, 626, 2024
8JTC
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BU of 8jtc by Molmil
Human VMAT2 complex with reserpine
分子名称: Synaptic vesicular amine transporter, reserpine
著者Jiang, D.H, Wu, D.
登録日2023-06-21
公開日2023-11-29
最終更新日2024-02-21
実験手法ELECTRON MICROSCOPY (3.52 Å)
主引用文献Transport and inhibition mechanisms of human VMAT2.
Nature, 626, 2024
8JT9
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BU of 8jt9 by Molmil
Human VMAT2 complex with ketanserin
分子名称: 3-[2-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]ethyl]-1~{H}-quinazoline-2,4-dione, Synaptic vesicular amine transporter
著者Jiang, D.H, Wu, D.
登録日2023-06-21
公開日2023-11-29
最終更新日2025-06-25
実験手法ELECTRON MICROSCOPY (2.97 Å)
主引用文献Transport and inhibition mechanisms of human VMAT2.
Nature, 626, 2024
8JTA
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BU of 8jta by Molmil
Human VMAT2 complex with tetrabenazine
分子名称: Synaptic vesicular amine transporter, tetrabenazine
著者Jiang, D.H, Wu, D.
登録日2023-06-21
公開日2023-11-29
最終更新日2025-07-02
実験手法ELECTRON MICROSCOPY (3.36 Å)
主引用文献Transport and inhibition mechanisms of human VMAT2.
Nature, 626, 2024
8XXS
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BU of 8xxs by Molmil
Crystal structure of PDE4D catalytic domain complexed with L11
分子名称: 2-[4-[bis(fluoranyl)methoxy]-3-(cyclopropylmethoxy)phenyl]-1-benzofuran-6-ol, MAGNESIUM ION, ZINC ION, ...
著者Wu, D, Huang, Y.-Y, Luo, H.-B.
登録日2024-01-19
公開日2025-01-22
最終更新日2025-03-12
実験手法X-RAY DIFFRACTION (2.10000944 Å)
主引用文献5-hydroxymethylcytosine features of portal venous blood predict metachronous liver metastases of colorectal cancer and reveal phosphodiesterase 4 as a therapeutic target.
Clin Transl Med, 15, 2025
5H2Z
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BU of 5h2z by Molmil
Crystal structure of Human Dihydroorotate Dehydrogenase (DHODH) with 7GF
分子名称: ACETATE ION, Dihydroorotate dehydrogenase (quinone), mitochondrial, ...
著者Wu, D, Huang, J.
登録日2016-10-19
公開日2017-03-01
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.58 Å)
主引用文献Crystal structure of Human Dihydroorotate Dehydrogenase (DHODH) with 7GF
To Be Published
8XOA
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BU of 8xoa by Molmil
VMAT2 complex with MPP+
分子名称: 1-methyl-4-phenylpyridin-1-ium, Synaptic vesicular amine transporter,Synaptic vesicular amine transporter,transporterA
著者Jiang, D.H, Wu, D.
登録日2023-12-31
公開日2024-05-08
最終更新日2025-06-18
実験手法ELECTRON MICROSCOPY (3.03 Å)
主引用文献Structural snapshots of human VMAT2 reveal insights into substrate recognition and proton coupling mechanism.
Cell Res., 34, 2024
8XO9
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BU of 8xo9 by Molmil
VMAT2 complex with noradrenaline in cytosol-facing state
分子名称: Noradrenaline, Synaptic vesicular amine transporter,Synaptic vesicular amine transporter,transporter A
著者Jiang, D.H, Wu, D.
登録日2023-12-31
公開日2024-05-08
最終更新日2025-07-02
実験手法ELECTRON MICROSCOPY (3.2 Å)
主引用文献Structural snapshots of human VMAT2 reveal insights into substrate recognition and proton coupling mechanism.
Cell Res., 34, 2024
8XOB
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BU of 8xob by Molmil
VMAT2 protonated state
分子名称: Synaptic vesicular amine transporter,transporter B
著者Jiang, D.H, Wu, D.
登録日2023-12-31
公開日2024-05-08
最終更新日2025-07-02
実験手法ELECTRON MICROSCOPY (3.15 Å)
主引用文献Structural snapshots of human VMAT2 reveal insights into substrate recognition and proton coupling mechanism.
Cell Res., 34, 2024
6IKM
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BU of 6ikm by Molmil
Crystal structure of SpuE-Spermidine in complex with ScFv5
分子名称: Polyamine transport protein, SPERMIDINE, SULFATE ION, ...
著者Wu, D, Sun, X.
登録日2018-10-16
公開日2019-12-25
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (3.398 Å)
主引用文献A Potent Anti-SpuE Antibody Allosterically Inhibits Type III Secretion System and Attenuates Virulence of Pseudomonas Aeruginosa.
J.Mol.Biol., 431, 2019
7XC5
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BU of 7xc5 by Molmil
Crystal structure of the ANK domain of CLPB
分子名称: Isoform 2 of Caseinolytic peptidase B protein homolog
著者Liu, Y, Wu, D, Lu, G, Gao, N, Lin, J.
登録日2022-03-23
公開日2023-01-18
最終更新日2024-05-29
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Comprehensive structural characterization of the human AAA+ disaggregase CLPB in the apo- and substrate-bound states reveals a unique mode of action driven by oligomerization.
Plos Biol., 21, 2023
3D04
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BU of 3d04 by Molmil
Crystal structure of (3R)-Hydroxyacyl-Acyl Carrier Protein Dehydratase (FabZ) from Helicobacter pylori in complex with sakuranetin
分子名称: (2S)-5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-2,3-dihydro-4H-chromen-4-one, (3R)-hydroxymyristoyl-acyl carrier protein dehydratase, BENZAMIDINE, ...
著者Zhang, L, Kong, Y, Wu, D, Shen, X, Jiang, H.
登録日2008-05-01
公開日2008-12-09
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Three flavonoids targeting the beta-hydroxyacyl-acyl carrier protein dehydratase from Helicobacter pylori: crystal structure characterization with enzymatic inhibition assay
Protein Sci., 17, 2008
9LO7
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BU of 9lo7 by Molmil
The crystal structure of PDE4D with 2317b
分子名称: 3',5'-cyclic-AMP phosphodiesterase 4D, MAGNESIUM ION, ZINC ION, ...
著者Huag, Y.-Y, Wu, D, Luo, H.-B.
登録日2025-01-22
公開日2025-03-26
最終更新日2025-04-09
実験手法X-RAY DIFFRACTION (2.20006251 Å)
主引用文献Structure-Based Optimization of Moracin M as Potent and Selective PDE4 Inhibitors with Antipsoriasis Effects.
J.Med.Chem., 68, 2025
6KUW
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BU of 6kuw by Molmil
Crystal structure of human alpha2C adrenergic G protein-coupled receptor.
分子名称: (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, (8~{a}~{R},12~{a}~{S},13~{a}~{R})-12-ethylsulfonyl-3-methoxy-5,6,8,8~{a},9,10,11,12~{a},13,13~{a}-decahydroisoquinolino[2,1-g][1,6]naphthyridine, Alpha-2C adrenergic receptor, ...
著者Chen, X.Y, Wu, L.J, Wu, D, Zhong, G.S.
登録日2019-09-02
公開日2019-12-04
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Crystal structure of human alpha2C adrenergic G protein-coupled receptor.
To Be Published
8QCS
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BU of 8qcs by Molmil
Cryo-EM structure of the inward-facing FLVCR1
分子名称: Heme transporter FLVCR1
著者Weng, T.-H, Wu, D, Safarian, S.
登録日2023-08-28
公開日2024-04-17
最終更新日2024-06-19
実験手法ELECTRON MICROSCOPY (2.9 Å)
主引用文献Molecular mechanism of choline and ethanolamine transport in humans.
Nature, 630, 2024
8QCT
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BU of 8qct by Molmil
Cryo-EM structure of the inward-facing choline-bound FLVCR1
分子名称: CHOLINE ION, Heme transporter FLVCR1
著者Weng, T.-H, Wu, D, Safarian, S.
登録日2023-08-28
公開日2024-04-17
最終更新日2024-06-19
実験手法ELECTRON MICROSCOPY (2.6 Å)
主引用文献Molecular mechanism of choline and ethanolamine transport in humans.
Nature, 630, 2024

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件を2025-07-09に公開中

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