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9JER
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Arginine decarboxylase in Aspergillus oryzae, ligand-free form
分子名称: 1,2-ETHANEDIOL, DI(HYDROXYETHYL)ETHER, L-tryptophan decarboxylase PsiD-like domain-containing protein
著者Mikami, B, Yasukawa, K, Fujiwara, S, Takita, T, Mizutani, K, Odagaki, Y, Murakami, Y.
登録日2024-09-03
公開日2024-10-09
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Unveiling the reaction mechanism of arginine decarboxylase in Aspergillus oryzae: Insights from crystal structure analysis.
Biochem.Biophys.Res.Commun., 733, 2024
9JF5
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Arginine decarboxylase in Aspergillus oryzae complexed with arginine
分子名称: 1,2-ETHANEDIOL, AGMATINE, DI(HYDROXYETHYL)ETHER, ...
著者Mikami, B, Yasukawa, K, Fujiwara, S, Takita, T, Mizutani, K, Odagaki, Y, Murakami, Y.
登録日2024-09-04
公開日2024-10-09
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Unveiling the reaction mechanism of arginine decarboxylase in Aspergillus oryzae: Insights from crystal structure analysis.
Biochem.Biophys.Res.Commun., 733, 2024
9JFN
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Arginine decarboxylase in Aspergillus oryzae complexed with agmatine
分子名称: 1,2-ETHANEDIOL, AGMATINE, DI(HYDROXYETHYL)ETHER, ...
著者Mikami, B, Yasukawa, K, Fujiwara, S, Takita, T, Mizutani, K, Odagaki, Y, Murakami, Y.
登録日2024-09-05
公開日2024-10-09
実験手法X-RAY DIFFRACTION (2.15 Å)
主引用文献Unveiling the reaction mechanism of arginine decarboxylase in Aspergillus oryzae: Insights from crystal structure analysis.
Biochem.Biophys.Res.Commun., 733, 2024
9D2X
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BU of 9d2x by Molmil
SpiD ETS-domain (168-273) in complex with the DNA sequence d(AATAAAAGGAAGTGGG)
分子名称: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, DNA (5'-D(*AP*AP*TP*AP*AP*AP*AP*GP*GP*AP*AP*GP*TP*GP*GP*G)-3'), DNA (5'-D(*TP*CP*CP*CP*AP*CP*TP*TP*CP*CP*TP*TP*TP*TP*AP*T)-3'), ...
著者Terrell, J.R, Vernon, T.N, Poon, G.M.K.
登録日2024-08-09
公開日2024-10-30
実験手法X-RAY DIFFRACTION (2.29 Å)
主引用文献The Structure of the DNA-binding Domain of the Class III ETS-Family Member SpiD from Raja eglanteria
To be published
9JHV
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Crystal Structure of 5'-Deoxy-5'-methylthioadenosine phosphorylase from Aeropyrum pernix complex with 5'-Deoxy-5'-methylthioadenosine 343K
分子名称: 5'-DEOXY-5'-METHYLTHIOADENOSINE, DI(HYDROXYETHYL)ETHER, PHOSPHATE ION, ...
著者Iizuka, Y, Kikuchi, M, Yamauchi, T, Tsunoda, M.
登録日2024-09-10
公開日2024-09-25
最終更新日2024-10-09
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Crystal Structure of 5'-Deoxy-5'-methylthioadenosine phosphorylase from Aeropyrum pernix complex with 5'-Deoxy-5'-methylthioadenosine 353K
To Be Published
9DOC
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BU of 9doc by Molmil
The von Willebrand factor A domain of human capillary morphogenesis gene II, flexibly fused to the 1TEL crystallization chaperone, Thr-Val linker variant, at 1.2 Angstrom resolution
分子名称: GLYCEROL, MAGNESIUM ION, PHOSPHATE ION, ...
著者Samarawickrama, P, Probst, R, Ludlow, K, Doukov, T, Moody, J.D.
登録日2024-09-18
公開日2024-11-06
実験手法X-RAY DIFFRACTION (1.19 Å)
主引用文献1TEL Fusions Outperform 2TEL and 3TEL Fusions in Controlled Comparisons
To be published
9DLW
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BU of 9dlw by Molmil
Crystal structure of the ternary complex of DCAF1 and WDR5 with PROTAC, OICR-41114
分子名称: DDB1- and CUL4-associated factor 1, N-{(1P)-5'-({(32E)-33-[(3P)-4-{[(1S)-3-amino-1-(3-chloro-4-fluorophenyl)-3-oxopropyl]carbamoyl}-3-(4-chloro-2-fluorophenyl)-1H-pyrrol-2-yl]-31-oxo-3,6,9,12,15,18,21,24,27-nonaoxa-30-azatritriacont-32-en-1-yl}carbamoyl)-2'-fluoro-4-[(3R,5S)-3,4,5-trimethylpiperazin-1-yl][1,1'-biphenyl]-3-yl}-6-oxo-4-(trifluoromethyl)-1,6-dihydropyridine-3-carboxamide, WD repeat-containing protein 5
著者Mabanglo, M.F, Mamai, A, Wilson, B.J, Hoffer, L, Al-awar, R, Vedadi, M.
登録日2024-09-11
公開日2024-11-06
実験手法X-RAY DIFFRACTION (2.07 Å)
主引用文献Crystal structures of DCAF1-PROTAC-WDR5 complexes provide insight into DCAF1 substrate specificity
To Be Published
9FVC
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BU of 9fvc by Molmil
Crystal structure of VcSiaP in complex with a VHH antibody (VHH_VcP#1)
分子名称: Sialic acid-binding periplasmic protein SiaP, VHH_VcP#2
著者Schneberger, N, Hagelueken, G.
登録日2024-06-26
公開日2024-11-06
実験手法X-RAY DIFFRACTION (2.64 Å)
主引用文献Crystal structure of VcSiaP in complex with a VHH antibody (VHH_VcP#1)
To Be Published
5KCV
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BU of 5kcv by Molmil
Crystal structure of allosteric inhibitor, ARQ 092, in complex with autoinhibited form of AKT1
分子名称: 3-[3-[4-(1-azanylcyclobutyl)phenyl]-5-phenyl-imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine, RAC-alpha serine/threonine-protein kinase
著者Eathiraj, S.
登録日2016-06-07
公開日2016-06-29
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献Discovery of 3-(3-(4-(1-Aminocyclobutyl)phenyl)-5-phenyl-3H-imidazo[4,5-b]pyridin-2-yl)pyridin-2-amine (ARQ 092): An Orally Bioavailable, Selective, and Potent Allosteric AKT Inhibitor.
J.Med.Chem., 59, 2016
9JKQ
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BU of 9jkq by Molmil
Cryo-EM structure of the METH-bound hTAAR1-Gs complex
分子名称: (2S)-N-methyl-1-phenylpropan-2-amine, Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2, Guanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1, ...
著者Lin, Y, Wang, J, Shi, F.
登録日2024-09-16
公開日2024-10-16
最終更新日2024-11-06
実験手法ELECTRON MICROSCOPY (2.66 Å)
主引用文献Molecular Mechanisms of Methamphetamine-Induced Addiction via TAAR1 Activation.
J.Med.Chem., 67, 2024
9DR0
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BU of 9dr0 by Molmil
Hare calicivirus protruding domain
分子名称: 1,2-ETHANEDIOL, ACETIC ACID, Hare calicivirus protruding domain
著者Reese, T, Pancera, M, Hansman, G.
登録日2024-09-24
公開日2024-10-30
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献Hare calicivirus protruding domain
To Be Published
5KCF
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Crystal Structure of the ER-alpha Ligand-binding Domain (Y537S) in Complex with an N-ethyl, 4-methoxybenzyl OBHS-N derivative
分子名称: (1R,2S,4R)-N-ethyl-5,6-bis(4-hydroxyphenyl)-N-(4-methoxyphenyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-sulfonamide, (1S,2R,4S)-N-ethyl-5,6-bis(4-hydroxyphenyl)-N-(4-methoxyphenyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-sulfonamide, Estrogen receptor, ...
著者Nwachukwu, J.C, Srinivasan, S, Bruno, N.E, Dharmarajan, V, Goswami, D, Kastrati, I, Novick, S, Nowak, J, Zhou, H.B, Boonmuen, N, Zhao, Y, Min, J, Frasor, J, Katzenellenbogen, B.S, Griffin, P.R, Katzenellenbogen, J.A, Nettles, K.W.
登録日2016-06-06
公開日2016-11-16
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (2.07 Å)
主引用文献Full antagonism of the estrogen receptor without a prototypical ligand side chain.
Nat. Chem. Biol., 13, 2017
5KCT
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BU of 5kct by Molmil
Crystal Structure of the ER-alpha Ligand-binding Domain (Y537S) in Complex with an N-ethyl, 4-chlorobenzyl OBHS-N derivative
分子名称: (1R,2S,4R)-N-(4-chlorophenyl)-N-ethyl-5,6-bis(4-hydroxyphenyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-sulfonamide, (1S,2R,4S)-N-(4-chlorophenyl)-N-ethyl-5,6-bis(4-hydroxyphenyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-sulfonamide, Estrogen receptor, ...
著者Nwachukwu, J.C, Srinivasan, S, Bruno, N.E, Dharmarajan, V, Goswami, D, Kastrati, I, Novick, S, Nowak, J, Zhou, H.B, Boonmuen, N, Zhao, Y, Min, J, Frasor, J, Katzenellenbogen, B.S, Griffin, P.R, Katzenellenbogen, J.A, Nettles, K.W.
登録日2016-06-07
公開日2016-11-16
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Full antagonism of the estrogen receptor without a prototypical ligand side chain.
Nat. Chem. Biol., 13, 2017
9JQ8
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BU of 9jq8 by Molmil
Roadblock2 homodimer structure from Candidatus Prometheoarchaeum syntrophicum strain MK-D1
分子名称: Roadblock/LC7 domain protein
著者Ponlachantra, K, Robinson, R.C.
登録日2024-09-27
公開日2024-10-30
実験手法X-RAY DIFFRACTION (1.79 Å)
主引用文献Roadblock domain protein from Asgard archaea
To Be Published
9JQ9
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BU of 9jq9 by Molmil
Crystal structure of Plasmoredoxin from Plasmodium falciparum a disulfide oxidoreductase protein unique to Plasmodium species
分子名称: Plasmoredoxin
著者Panicker, L.
登録日2024-09-27
公開日2024-10-16
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Crystal structure of Plasmoredoxin from Plasmodium falciparum a disulfide oxidoreductase protein unique to Plasmodium species
To Be Published
9JQF
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BU of 9jqf by Molmil
Crystal structure of the CJ0600 protein from Campylobacter jejuni
分子名称: 1-aminocyclopropane-1-carboxylate deaminase/D-cysteine desulfhydrase, SULFATE ION
著者Ki, D.U, Choi, H.J, Song, W.S, Yoon, S.I.
登録日2024-09-27
公開日2024-11-06
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Structural analysis of the CJ0600 protein from Campylobacter jejuni.
Biochem.Biophys.Res.Commun., 735, 2024
9JQI
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BU of 9jqi by Molmil
Crystal structure of calmodulin in complex with KN93 (1:1 complex)
分子名称: CALCIUM ION, Calmodulin-1, N-[2-[[[3-(4'-Chlorophenyl)-2-propenyl]methylamino]methyl]phenyl]-N-(2-hydroxyethyl)-4'-methoxybenzenesulfonamide
著者Liu, X.C.
登録日2024-09-27
公開日2024-11-06
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Crystal structure of calmodulin in complex with KN93 (1:1 complex)
To Be Published
9JR2
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BU of 9jr2 by Molmil
Cryo-EM structure of PTH-PTH1R-Gq (upright state)
分子名称: Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2, Guanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1, Guanine nucleotide-binding protein G(q) subunit alpha-1 (miniGq), ...
著者Sano, F.K, Hirano, H, Itoh, Y, Nureki, O.
登録日2024-09-29
公開日2024-10-16
最終更新日2024-11-06
実験手法ELECTRON MICROSCOPY (2.8 Å)
主引用文献Insights into G-protein coupling preference from cryo-EM structures of Gq-bound PTH1R
To Be Published
9JR3
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Cryo-EM structure of PTH-PTH1R-Gq (tilted state)
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2, Guanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1, ...
著者Sano, F.K, Hirano, H, Itoh, Y, Nureki, O.
登録日2024-09-29
公開日2024-10-16
最終更新日2024-11-06
実験手法ELECTRON MICROSCOPY (2.8 Å)
主引用文献Insights into G-protein coupling preference from cryo-EM structures of Gq-bound PTH1R
To Be Published
9FVB
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BU of 9fvb by Molmil
Crystal structure of VcSiaP in complex with a VHH antibody (VHH_VcP#2)
分子名称: GLYCEROL, IMIDAZOLE, Sialic acid-binding periplasmic protein SiaP, ...
著者Schneberger, N, Hagelueken, G.
登録日2024-06-26
公開日2024-11-06
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Allosteric substrate release by sialic acid TRAP transporter SBPs
To Be Published
9D6D
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BU of 9d6d by Molmil
Gag CA-SP1 immature lattice bound with Lenacapavir from enveloped virus like particles
分子名称: Gag polyprotein, INOSITOL HEXAKISPHOSPHATE, N-[(1S)-1-(3-{4-chloro-3-[(methylsulfonyl)amino]-1-(2,2,2-trifluoroethyl)-1H-indazol-7-yl}-6-[3-methyl-3-(methylsulfonyl)but-1-yn-1-yl]pyridin-2-yl)-2-(3,5-difluorophenyl)ethyl]-2-[(3bS,4aR)-5,5-difluoro-3-(trifluoromethyl)-3b,4,4a,5-tetrahydro-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyrazol-1-yl]acetamide
著者Wu, C, Meuser, M.E, Xiong, Y.
登録日2024-08-14
公開日2024-10-30
実験手法ELECTRON MICROSCOPY (2.18 Å)
主引用文献Structural insights into inhibitor mechanisms on immature HIV-1 Gag lattice revealed by high-resolution in situ single-particle cryo-EM.
Biorxiv, 2024
9JUE
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BU of 9jue by Molmil
Roadblock3 homodimer structure from Candidatus Prometheoarchaeum syntrophicum strain MK-D1
分子名称: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, Roadblock/LC7 domain protein
著者Ponlachantra, K, Robinson, R.C.
登録日2024-10-08
公開日2024-10-16
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Roadblock domain protein from Asgard archaea
To Be Published
9JX6
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BU of 9jx6 by Molmil
Crystal Structure of wild type Ab-ohrB
分子名称: Organic hydroperoxide resistance protein
著者Huang, W, Hu, C.X.
登録日2024-10-11
公開日2024-11-06
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Crystal Structure of 6D1-Ab-ohrB complex
To be published
9K2L
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BU of 9k2l by Molmil
Crystal structure of Plasmoredoxin, a disulfide oxidoreductase from Plasmodium falciparum crystallized in the presence of Glutathione(GSH)
分子名称: Plasmoredoxin, SULFATE ION
著者Panicker, L.
登録日2024-10-17
公開日2024-10-30
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Crystal structure of Plasmoredoxin, a disulfide oxidoreductase from Plasmodium falciparum crystallized in the presence of Glutathione(GSH)
To Be Published
9E4V
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BU of 9e4v by Molmil
The structure of human vacuolar protein sorting 34 catalytic domain bound to MES
分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, CHLORIDE ION, DI(HYDROXYETHYL)ETHER, ...
著者Abiodun, W.O, Fullmer, A, Tsubaki, E, Doukov, T, Moody, J.D.
登録日2024-10-25
公開日2024-11-06
実験手法X-RAY DIFFRACTION (2.36 Å)
主引用文献Facile Bacterial Production of Human Vacuolar Protein Sorting 34 Enables Structural Characterization of Novel Inhibitors
To Be Published

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件を2024-11-13に公開中

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