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7HA1
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BU of 7ha1 by Molmil
PanDDA analysis group deposition -- Crystal structure of HSP90N in complex with FL0092
分子名称: 5-bromo-3,3-dimethyl-1,3-dihydro-2H-indol-2-one, Heat shock protein HSP 90-alpha
著者Huang, L, Wang, W, Zhu, Z, Li, Q, Li, M, Zhou, H, Xu, Q, Wen, W, Wang, Q, Yu, F.
登録日2024-07-10
公開日2025-03-26
実験手法X-RAY DIFFRACTION (1.46 Å)
主引用文献Novel starting points for fragment-based drug design against human heat-shock protein 90 identified using crystallographic fragment screening.
Iucrj, 12, 2025
7H9N
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BU of 7h9n by Molmil
PanDDA analysis group deposition -- Crystal structure of HSP90N in complex with Fr13347
分子名称: 3-(2-phenylethyl)-2-sulfanylideneimidazolidin-4-one, Heat shock protein HSP 90-alpha
著者Huang, L, Wang, W, Zhu, Z, Li, Q, Li, M, Zhou, H, Xu, Q, Wen, W, Wang, Q, Yu, F.
登録日2024-07-10
公開日2025-03-26
実験手法X-RAY DIFFRACTION (2.35 Å)
主引用文献Novel starting points for fragment-based drug design against human heat-shock protein 90 identified using crystallographic fragment screening.
Iucrj, 12, 2025
7H9K
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BU of 7h9k by Molmil
PanDDA analysis group deposition -- Crystal structure of HSP90N in complex with Fr12478
分子名称: (1s,5s)-N-hydroxybicyclo[3.3.1]nonane-1-carboxamide, Heat shock protein HSP 90-alpha
著者Huang, L, Wang, W, Zhu, Z, Li, Q, Li, M, Zhou, H, Xu, Q, Wen, W, Wang, Q, Yu, F.
登録日2024-07-10
公開日2025-03-26
実験手法X-RAY DIFFRACTION (1.66 Å)
主引用文献Novel starting points for fragment-based drug design against human heat-shock protein 90 identified using crystallographic fragment screening.
Iucrj, 12, 2025
7H9Z
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BU of 7h9z by Molmil
PanDDA analysis group deposition -- Crystal structure of HSP90N in complex with Fr12500
分子名称: Heat shock protein HSP 90-alpha, N-[(1R,2S,4S)-bicyclo[2.2.1]heptan-2-yl]-N'-methylthiourea
著者Huang, L, Wang, W, Zhu, Z, Li, Q, Li, M, Zhou, H, Xu, Q, Wen, W, Wang, Q, Yu, F.
登録日2024-07-10
公開日2025-03-26
実験手法X-RAY DIFFRACTION (2.06 Å)
主引用文献Novel starting points for fragment-based drug design against human heat-shock protein 90 identified using crystallographic fragment screening.
Iucrj, 12, 2025
7HAF
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BU of 7haf by Molmil
PanDDA analysis group deposition -- Crystal structure of HSP90N in complex with Fr13854
分子名称: (2M)-2-(1H-imidazol-1-yl)benzonitrile, Heat shock protein HSP 90-alpha
著者Huang, L, Wang, W, Zhu, Z, Li, Q, Li, M, Zhou, H, Xu, Q, Wen, W, Wang, Q, Yu, F.
登録日2024-07-10
公開日2025-03-26
実験手法X-RAY DIFFRACTION (1.61 Å)
主引用文献Novel starting points for fragment-based drug design against human heat-shock protein 90 identified using crystallographic fragment screening.
Iucrj, 12, 2025
7HB4
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BU of 7hb4 by Molmil
PanDDA analysis group deposition -- Crystal structure of HSP90N in complex with Fr14472
分子名称: Heat shock protein HSP 90-alpha, N-(3-methylphenyl)thiourea
著者Huang, L, Wang, W, Zhu, Z, Li, Q, Li, M, Zhou, H, Xu, Q, Wen, W, Wang, Q, Yu, F.
登録日2024-07-10
公開日2025-03-26
実験手法X-RAY DIFFRACTION (1.87 Å)
主引用文献Novel starting points for fragment-based drug design against human heat-shock protein 90 identified using crystallographic fragment screening.
Iucrj, 12, 2025
7HA4
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BU of 7ha4 by Molmil
PanDDA analysis group deposition -- Crystal structure of HSP90N in complex with Fr14240
分子名称: 2-chloro-4-(trifluoromethyl)benzene-1-sulfonamide, Heat shock protein HSP 90-alpha
著者Huang, L, Wang, W, Zhu, Z, Li, Q, Li, M, Zhou, H, Xu, Q, Wen, W, Wang, Q, Yu, F.
登録日2024-07-10
公開日2025-03-26
実験手法X-RAY DIFFRACTION (1.61 Å)
主引用文献Novel starting points for fragment-based drug design against human heat-shock protein 90 identified using crystallographic fragment screening.
Iucrj, 12, 2025
4GYD
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BU of 4gyd by Molmil
Nostoc sp Cytochrome c6
分子名称: Cytochrome c6, HEME C
著者Skubak, P, Ubbink, M, Cavazzini, D, Rossi, G.L, Pannu, N.S.
登録日2012-09-05
公開日2013-09-11
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献The dynamic complex of cytochrome c6 and cytochrome f studied with paramagnetic NMR spectroscopy
Biochim.Biophys.Acta, 1837, 2014
7H9M
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BU of 7h9m by Molmil
PanDDA analysis group deposition -- Crystal structure of HSP90N in complex with Fr13527
分子名称: (1m)-1-(2,4-difluorophenyl)-4-methylpiperidine-2,6-dione, Heat shock protein HSP 90-alpha
著者Huang, L, Wang, W, Zhu, Z, Li, Q, Li, M, Zhou, H, Xu, Q, Wen, W, Wang, Q, Yu, F.
登録日2024-07-10
公開日2025-03-26
実験手法X-RAY DIFFRACTION (1.49 Å)
主引用文献Novel starting points for fragment-based drug design against human heat-shock protein 90 identified using crystallographic fragment screening.
Iucrj, 12, 2025
7H9X
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BU of 7h9x by Molmil
PanDDA analysis group deposition -- Crystal structure of HSP90N in complex with Fr14128
分子名称: 3,4-dimethylbenzamide, Heat shock protein HSP 90-alpha
著者Huang, L, Wang, W, Zhu, Z, Li, Q, Li, M, Zhou, H, Xu, Q, Wen, W, Wang, Q, Yu, F.
登録日2024-07-10
公開日2025-03-26
実験手法X-RAY DIFFRACTION (1.47 Å)
主引用文献Novel starting points for fragment-based drug design against human heat-shock protein 90 identified using crystallographic fragment screening.
Iucrj, 12, 2025
6UTE
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BU of 6ute by Molmil
Crystal structure of Z032 Fab in complex with WNV EDIII
分子名称: Envelope domain III, GLYCEROL, Z032 Fab heavy chain, ...
著者Esswein, S.R, Gristick, H.B, Keeffe, J.R, Bjorkman, P.J.
登録日2019-10-29
公開日2020-04-15
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献Structural basis for Zika envelope domain III recognition by a germline version of a recurrent neutralizing antibody.
Proc.Natl.Acad.Sci.USA, 117, 2020
4PGU
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BU of 4pgu by Molmil
Crystal structure of YetJ from Bacillus Subtilis at pH 7 by soaking
分子名称: Uncharacterized protein YetJ
著者Liu, Q, Chang, Y, Hendrickson, W.A, New York Consortium on Membrane Protein Structure (NYCOMPS)
登録日2014-05-02
公開日2014-06-04
最終更新日2023-12-27
実験手法X-RAY DIFFRACTION (3.401 Å)
主引用文献Structural basis for a pH-sensitive calcium leak across membranes.
Science, 344, 2014
6CM9
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BU of 6cm9 by Molmil
Structure of the cargo bound AP-1:Arf1:tetherin-Nef closed trimer monomeric subunit
分子名称: ADP-ribosylation factor 1, AP-1 complex subunit beta-1, AP-1 complex subunit gamma-1, ...
著者Morris, K.L, Buffalo, C.Z, Ren, X, Hurley, J.H.
登録日2018-03-03
公開日2018-08-08
最終更新日2024-03-13
実験手法ELECTRON MICROSCOPY (3.73 Å)
主引用文献HIV-1 Nefs Are Cargo-Sensitive AP-1 Trimerization Switches in Tetherin Downregulation.
Cell, 174, 2018
7HA8
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BU of 7ha8 by Molmil
PanDDA analysis group deposition -- Crystal structure of HSP90N in complex with Fr14439
分子名称: Heat shock protein HSP 90-alpha, N-[(1R,2S,4R)-bicyclo[2.2.1]heptan-2-yl]-N'-[2-(pyridin-2-yl)ethyl]thiourea
著者Huang, L, Wang, W, Zhu, Z, Li, Q, Li, M, Zhou, H, Xu, Q, Wen, W, Wang, Q, Yu, F.
登録日2024-07-10
公開日2025-03-26
実験手法X-RAY DIFFRACTION (2.22 Å)
主引用文献Novel starting points for fragment-based drug design against human heat-shock protein 90 identified using crystallographic fragment screening.
Iucrj, 12, 2025
6UTU
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BU of 6utu by Molmil
Crystal structure of minor pseudopilin ternary complex of XcpVWX from the Type 2 secretion system of Pseudomonas aeruginosa in the P3 space group
分子名称: CALCIUM ION, Type II secretion system protein I, Type II secretion system protein J, ...
著者Zhang, Y, Wang, S, Jia, Z.
登録日2019-10-30
公開日2020-09-02
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.85 Å)
主引用文献In Situ Proteolysis Condition-Induced Crystallization of the XcpVWX Complex in Different Lattices.
Int J Mol Sci, 21, 2020
4ZCG
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BU of 4zcg by Molmil
Crystal Structure of human GGT1 in complex with Glutamate (with all atoms of glutamate)
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, CHLORIDE ION, GLUTAMIC ACID, ...
著者Terzyan, S, Hanigan, M.
登録日2015-04-15
公開日2015-06-03
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (2.22 Å)
主引用文献Human gamma-Glutamyl Transpeptidase 1: STRUCTURES OF THE FREE ENZYME, INHIBITOR-BOUND TETRAHEDRAL TRANSITION STATES, AND GLUTAMATE-BOUND ENZYME REVEAL NOVEL MOVEMENT WITHIN THE ACTIVE SITE DURING CATALYSIS.
J.Biol.Chem., 290, 2015
7HAE
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BU of 7hae by Molmil
PanDDA analysis group deposition -- Crystal structure of HSP90N in complex with Fr13215
分子名称: Heat shock protein HSP 90-alpha, N-[(1R,2R,4S)-bicyclo[2.2.1]hept-5-en-2-yl]-N'-(2-hydroxyethyl)thiourea
著者Huang, L, Wang, W, Zhu, Z, Li, Q, Li, M, Zhou, H, Xu, Q, Wen, W, Wang, Q, Yu, F.
登録日2024-07-10
公開日2025-03-26
実験手法X-RAY DIFFRACTION (1.73 Å)
主引用文献Novel starting points for fragment-based drug design against human heat-shock protein 90 identified using crystallographic fragment screening.
Iucrj, 12, 2025
4ZL6
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BU of 4zl6 by Molmil
Crystal structure of the PmFTN variant E44H soaked in iron (3 h)
分子名称: FE (III) ION, Ferritin
著者Pfaffen, S, Murphy, M.E.P.
登録日2015-05-01
公開日2015-09-30
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献A Diatom Ferritin Optimized for Iron Oxidation but Not Iron Storage.
J.Biol.Chem., 290, 2015
7HAD
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BU of 7had by Molmil
PanDDA analysis group deposition -- Crystal structure of HSP90N in complex with Fr14363
分子名称: 2,3-dimethylbenzamide, Heat shock protein HSP 90-alpha
著者Huang, L, Wang, W, Zhu, Z, Li, Q, Li, M, Zhou, H, Xu, Q, Wen, W, Wang, Q, Yu, F.
登録日2024-07-10
公開日2025-03-26
実験手法X-RAY DIFFRACTION (1.59 Å)
主引用文献Novel starting points for fragment-based drug design against human heat-shock protein 90 identified using crystallographic fragment screening.
Iucrj, 12, 2025
7HAM
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BU of 7ham by Molmil
PanDDA analysis group deposition -- Crystal structure of HSP90N in complex with Fr14242
分子名称: (1P)-1-(3-fluorophenyl)-1H-imidazole, Heat shock protein HSP 90-alpha
著者Huang, L, Wang, W, Zhu, Z, Li, Q, Li, M, Zhou, H, Xu, Q, Wen, W, Wang, Q, Yu, F.
登録日2024-07-10
公開日2025-03-26
実験手法X-RAY DIFFRACTION (1.77 Å)
主引用文献Novel starting points for fragment-based drug design against human heat-shock protein 90 identified using crystallographic fragment screening.
Iucrj, 12, 2025
6D3S
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BU of 6d3s by Molmil
Thermostabilized phosphorylated chicken CFTR
分子名称: ADENOSINE-5'-TRIPHOSPHATE, Cystic fibrosis transmembrane conductance regulator
著者Fay, J.F, Riordan, J.R, Chen, Z.J.
登録日2018-04-16
公開日2018-10-17
最終更新日2024-03-13
実験手法ELECTRON MICROSCOPY (6.6 Å)
主引用文献Cryo-EM Visualization of an Active High Open Probability CFTR Anion Channel.
Biochemistry, 57, 2018
7HB3
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BU of 7hb3 by Molmil
PanDDA analysis group deposition -- Crystal structure of HSP90N in complex with Fr13043
分子名称: Heat shock protein HSP 90-alpha, N-(3-chloro-4-fluorophenyl)thiourea
著者Huang, L, Wang, W, Zhu, Z, Li, Q, Li, M, Zhou, H, Xu, Q, Wen, W, Wang, Q, Yu, F.
登録日2024-07-10
公開日2025-03-26
実験手法X-RAY DIFFRACTION (2.34 Å)
主引用文献Novel starting points for fragment-based drug design against human heat-shock protein 90 identified using crystallographic fragment screening.
Iucrj, 12, 2025
6VDW
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BU of 6vdw by Molmil
Crystal Structure of Dehaloperoxidase B in Complex with cofactor Manganese(III) Porphyrin and Substrate 4-nitrophenol
分子名称: 1,2-ETHANEDIOL, DI(HYDROXYETHYL)ETHER, Dehaloperoxidase B, ...
著者Ghiladi, R.A, de Serrano, V.S, McGuire, A, Malewschik, T.
登録日2019-12-27
公開日2020-12-30
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Nonnative Heme Incorporation into Multifunctional Globin Increases Peroxygenase Activity an Order and Magnitude Compared to Native Enzyme
To Be Published
6CND
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BU of 6cnd by Molmil
Yeast RNA polymerase III natural open complex (nOC)
分子名称: DNA (71-MER), DNA-directed RNA polymerase III subunit RPC1, DNA-directed RNA polymerase III subunit RPC10, ...
著者Han, Y, He, Y.
登録日2018-03-08
公開日2018-08-22
最終更新日2024-11-20
実験手法ELECTRON MICROSCOPY (4.8 Å)
主引用文献Structural visualization of RNA polymerase III transcription machineries.
Cell Discov, 4, 2018
7HAL
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BU of 7hal by Molmil
PanDDA analysis group deposition -- Crystal structure of HSP90N in complex with Fr12580
分子名称: 2-(piperidin-1-yl)pyridine-4-carbonitrile, Heat shock protein HSP 90-alpha
著者Huang, L, Wang, W, Zhu, Z, Li, Q, Li, M, Zhou, H, Xu, Q, Wen, W, Wang, Q, Yu, F.
登録日2024-07-10
公開日2025-03-26
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Novel starting points for fragment-based drug design against human heat-shock protein 90 identified using crystallographic fragment screening.
Iucrj, 12, 2025

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件を2025-07-09に公開中

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