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4E0K
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BU of 4e0k by Molmil
Crystal Structure of the amyloid-fibril forming peptide KDWSFY derived from human Beta 2 Microglobulin (58-63)
分子名称: 2-{2-[2-(2-{2-[2-(2-ETHOXY-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHOXY]-ETHOXY}-ETHANOL, Amyloidogenic peptide segment KDWSFY, SODIUM ION
著者Zhao, M, Liu, C, Sawaya, M.R, Eisenberg, D.
登録日2012-03-04
公開日2012-12-19
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (0.97 Å)
主引用文献Out-of-register beta-sheets suggest a pathway to toxic amyloid aggregates.
Proc.Natl.Acad.Sci.USA, 109, 2012
4E0O
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BU of 4e0o by Molmil
SVQIVYK segment from human Tau (305-311) displayed on 54-membered macrocycle scaffold (form III)
分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, Cyclic pseudo-peptide SVQIVYK(ORN)EF(HAO)(4BF)K(ORN), PHOSPHATE ION
著者Zhao, M, Liu, C, Sawaya, M.R, Eisenberg, D.
登録日2012-03-04
公開日2012-12-19
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (1.82 Å)
主引用文献Out-of-register beta-sheets suggest a pathway to toxic amyloid aggregates.
Proc.Natl.Acad.Sci.USA, 109, 2012
4E0M
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BU of 4e0m by Molmil
SVQIVYK segment from human Tau (305-311) displayed on 54-membered macrocycle scaffold (form I)
分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, Cyclic pseudo-peptide SVQIVYK(ORN)EF(HAO)(4BF)K(ORN), PHOSPHATE ION
著者Zhao, M, Liu, C, Michael, S.R, Eisenberg, D.
登録日2012-03-04
公開日2013-02-13
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Out-of-register beta-sheets suggest a pathway to toxic amyloid aggregates
Proc.Natl.Acad.Sci.USA, 109, 2012
7E17
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BU of 7e17 by Molmil
Structure of dimeric uPAR
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, Urokinase plasminogen activator surface receptor
著者Cai, Y, Huang, M.
登録日2021-02-01
公開日2021-12-22
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.96 Å)
主引用文献Crystal structure and cellular functions of uPAR dimer
Nat Commun, 13, 2022
7F3M
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BU of 7f3m by Molmil
Crystal structure of FGFR4 kinase domain with PRN1371
分子名称: 6-[2,6-bis(chloranyl)-3,5-dimethoxy-phenyl]-2-(methylamino)-8-[3-(4-prop-2-enoylpiperazin-1-yl)propyl]pyrido[2,3-d]pyrimidin-7-one, Fibroblast growth factor receptor 4, SULFATE ION
著者Chen, X.J, Qu, L.Z, Dai, S.Y, Wei, H.D, Chen, Y.H.
登録日2021-06-16
公開日2022-01-12
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.289 Å)
主引用文献Structural insights into the potency and selectivity of covalent pan-FGFR inhibitors
Commun Chem, 5, 2022
3IEI
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BU of 3iei by Molmil
Crystal structure of human leucine carboxylmethyltransferase-1 in complex with S-adenosyl homocysteine
分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, GLYCEROL, Leucine carboxyl methyltransferase 1, ...
著者Xing, Y, Jeffry, P.D.
登録日2009-07-22
公開日2010-08-11
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Structural Insights into Novel Functions of a pro-survival PP2A-specific Methyltransferase
To be Published
7UAK
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BU of 7uak by Molmil
Structure of recombinantly assembled A53E alpha-synuclein fibrils
分子名称: Alpha-synuclein
著者Zhou, K, Zhou, H.
登録日2022-03-13
公開日2023-03-29
最終更新日2024-06-12
実験手法ELECTRON MICROSCOPY (3.38 Å)
主引用文献Cryo-EM structure of amyloid fibril formed by alpha-synuclein hereditary A53E mutation reveals a distinct protofilament interface.
J.Biol.Chem., 299, 2023
7DHT
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BU of 7dht by Molmil
Solution structure of ATG8f of Arabidopsis thaliana
分子名称: Autophagy-related protein 8f
著者Lee, K.M, Sun, S.L, Wong, K.B.
登録日2020-11-17
公開日2021-12-01
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Mechanistic insights into an atypical interaction between ATG8 and SH3P2 in Arabidopsis thaliana.
Autophagy, 18, 2022
7D57
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BU of 7d57 by Molmil
C-Src in complex with FIIN-2
分子名称: N-(4-{[3-(3,5-dimethoxyphenyl)-7-{[4-(4-methylpiperazin-1-yl)phenyl]amino}-2-oxo-3,4-dihydropyrimido[4,5-d]pyrimidin-1(2H)-yl]methyl}phenyl)propanamide, Proto-oncogene tyrosine-protein kinase Src, SULFATE ION
著者Chen, Y.H, Qu, L.Z.
登録日2020-09-25
公開日2021-10-13
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.104 Å)
主引用文献Structural insights into the potency and selectivity of covalent pan-FGFR inhibitors
Commun Chem, 5, 2022
8VDJ
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BU of 8vdj by Molmil
Crystal structure of SARS-CoV-2 3CL protease (3CLpro) as a covalent complex with EDP-235
分子名称: 3C-like proteinase nsp5, 4,6,7-trifluoro-N-{(2S)-1-[(3R,5'R)-5'-(iminomethyl)-2-oxo-1,2-dihydrospiro[indole-3,3'-pyrrolidin]-1'-yl]-4-methyl-1-oxopentan-2-yl}-N-methyl-1H-indole-2-carboxamide, THIOCYANATE ION
著者Cade, I.A, Rhodin, M.H.J.
登録日2023-12-15
公開日2024-08-14
実験手法X-RAY DIFFRACTION (2.002 Å)
主引用文献The small molecule inhibitor of SARS-CoV-2 3CLpro EDP-235 prevents viral replication and transmission in vivo.
Nat Commun, 15, 2024
4I5N
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BU of 4i5n by Molmil
Structural mechanism of trimeric PP2A holoenzyme involving PR70: insight for Cdc6 dephosphorylation
分子名称: CALCIUM ION, MANGANESE (II) ION, Microcystin-LR (MCLR) bound form, ...
著者Wlodarchak, N, Satyshur, K.A, Guo, F, Xing, Y.
登録日2012-11-28
公開日2013-05-08
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Structure of the Ca(2+)-dependent PP2A heterotrimer and insights into Cdc6 dephosphorylation.
Cell Res., 23, 2013
4I5J
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BU of 4i5j by Molmil
PP2A PR70 Holoenzyme
分子名称: CALCIUM ION, Serine/threonine-protein phosphatase 2A regulatory subunit B'' subunit alpha
著者Xing, Y, Jeffery, P.D, Shi, Y.
登録日2012-11-28
公開日2013-05-08
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.091 Å)
主引用文献Structure of the Ca(2+)-dependent PP2A heterotrimer and insights into Cdc6 dephosphorylation.
Cell Res., 23, 2013
4I5K
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BU of 4i5k by Molmil
PP2A PR70 Holoenzyme model3_diCa_rcsb.pdb bppnat5_extend.mtz
分子名称: CALCIUM ION, Serine/threonine-protein phosphatase 2A regulatory subunit B'' subunit alpha
著者Xing, Y, Jeffrey, P.D, Shi, Y.
登録日2012-11-28
公開日2013-05-08
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献Structure of the Ca(2+)-dependent PP2A heterotrimer and insights into Cdc6 dephosphorylation.
Cell Res., 23, 2013
5XN5
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BU of 5xn5 by Molmil
Homo-dimer crystal structure of geranylgeranyl diphosphate synthases 1 from Oryza sativa
分子名称: Os07g0580900 protein
著者Wang, C, Zhou, F, Lu, S, Zhang, P.
登録日2017-05-18
公開日2017-06-21
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.002 Å)
主引用文献A recruiting protein of geranylgeranyl diphosphate synthase controls metabolic flux toward chlorophyll biosynthesis in rice
Proc. Natl. Acad. Sci. U.S.A., 114, 2017
6ITE
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BU of 6ite by Molmil
Crystal structure of group A Streptococcal surface dehydrogenase (SDH)
分子名称: Glyceraldehyde-3-phosphate dehydrogenase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, SULFATE ION
著者Yuan, C, Li, R, Huang, M.D.
登録日2018-11-21
公開日2019-09-25
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (1.739 Å)
主引用文献Structural determination of group A Streptococcal surface dehydrogenase and characterization of its interaction with urokinase-type plasminogen activator receptor.
Biochem.Biophys.Res.Commun., 510, 2019
5Z9R
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BU of 5z9r by Molmil
NMNAT as a specific chaperone antagonizing pathological condensation of phosphorylated tau
分子名称: Nicotinamide/nicotinic acid mononucleotide adenylyltransferase 3
著者Dou, S, Ma, X, Li, D, Liu, C.
登録日2018-02-05
公開日2019-02-06
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Nicotinamide mononucleotide adenylyltransferase uses its NAD+substrate-binding site to chaperone phosphorylated Tau.
Elife, 9, 2020
5ZHH
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BU of 5zhh by Molmil
Structure of Inositol monophosphatase from Anabaena (Nostoc) sp. PCC 7120
分子名称: Inositol-1-monophosphatase
著者Zhang, S.R, Wang, F.K.
登録日2018-03-13
公開日2019-04-03
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (1.89 Å)
主引用文献Structure of Inositol monophosphatase from Anabaena (Nostoc) sp. PCC 7120
To Be Published
5XN6
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BU of 5xn6 by Molmil
Heterodimer crystal structure of geranylgeranyl diphosphate synthases 1 with GGPPS Recruiting Protein(OsGRP) from Oryza sativa
分子名称: Os02g0668100 protein, Os07g0580900 protein
著者Wang, C, Zhou, F, Lu, S, Zhang, P.
登録日2017-05-18
公開日2017-06-28
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (3.598 Å)
主引用文献A recruiting protein of geranylgeranyl diphosphate synthase controls metabolic flux toward chlorophyll biosynthesis in rice
Proc. Natl. Acad. Sci. U.S.A., 114, 2017
7VUA
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BU of 7vua by Molmil
Anaerobic hydroxyproline degradation involving C-N cleavage by a glycyl radical enzyme
分子名称: (4S)-4-hydroxy-D-proline, HplG
著者Duan, Y, Lu, Q, Yuchi, Z, Zhang, Y.
登録日2021-11-01
公開日2022-06-01
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2.695 Å)
主引用文献Anaerobic Hydroxyproline Degradation Involving C-N Cleavage by a Glycyl Radical Enzyme.
J.Am.Chem.Soc., 144, 2022
7VF6
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BU of 7vf6 by Molmil
The crystal structure of PurZ0
分子名称: GLYCEROL, GUANOSINE-5'-DIPHOSPHATE, PHOSPHATE ION, ...
著者Tong, Y, Zhang, Y.
登録日2021-09-10
公開日2023-05-24
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (1.703 Å)
主引用文献Alternative Z-genome biosynthesis pathway shows evolutionary progression from Archaea to phage.
Nat Microbiol, 8, 2023
8I2J
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BU of 8i2j by Molmil
E. coli tryptophanyl-tRNA synthetase bound with a chemical fragment at the dimerization interface
分子名称: 1-(4-methoxyphenyl)ethanone, SULFATE ION, TRYPTOPHANYL-5'AMP, ...
著者Xiang, M, Zhou, H.
登録日2023-01-14
公開日2023-04-12
最終更新日2024-05-29
実験手法X-RAY DIFFRACTION (2.65 Å)
主引用文献An asymmetric structure of bacterial TrpRS supports the half-of-the-sites catalytic mechanism and facilitates antimicrobial screening.
Nucleic Acids Res., 51, 2023
8I1Y
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BU of 8i1y by Molmil
The structure of E. coli TrpRS bound with a chemical fragment
分子名称: 5-ethanoylthiophene-2-carbonitrile, SULFATE ION, TRYPTOPHANYL-5'AMP, ...
著者Xiang, M, Zhou, H.
登録日2023-01-13
公開日2023-04-12
最終更新日2024-05-29
実験手法X-RAY DIFFRACTION (1.78 Å)
主引用文献An asymmetric structure of bacterial TrpRS supports the half-of-the-sites catalytic mechanism and facilitates antimicrobial screening.
Nucleic Acids Res., 51, 2023
8I27
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BU of 8i27 by Molmil
E. coli tryptophanyl-tRNA synthetase bound with a chemical fragment at the dimerization interface
分子名称: 1,2-ETHANEDIOL, 4-methoxybenzenecarbonitrile, SULFATE ION, ...
著者Xiang, M, Zhou, H.
登録日2023-01-14
公開日2023-04-12
最終更新日2024-05-29
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献An asymmetric structure of bacterial TrpRS supports the half-of-the-sites catalytic mechanism and facilitates antimicrobial screening.
Nucleic Acids Res., 51, 2023
8I2A
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BU of 8i2a by Molmil
E. coli tryptophanyl-tRNA synthetase bound with a chemical fragment at the dimerization interface
分子名称: 1,2-ETHANEDIOL, 5-METHOXYBENZIMIDAZOLE, SULFATE ION, ...
著者Xiang, M, Zhou, H.
登録日2023-01-14
公開日2023-04-12
最終更新日2024-05-29
実験手法X-RAY DIFFRACTION (2.35 Å)
主引用文献An asymmetric structure of bacterial TrpRS supports the half-of-the-sites catalytic mechanism and facilitates antimicrobial screening.
Nucleic Acids Res., 51, 2023
8I4I
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BU of 8i4i by Molmil
The asymmetric structure of homodimeric E. coli TrpRS bound with tryptophanyl adenylate and L-tryptophan
分子名称: SULFATE ION, TRYPTOPHAN, TRYPTOPHANYL-5'AMP, ...
著者Xiang, M, Zhou, H.
登録日2023-01-19
公開日2023-04-12
最終更新日2024-05-29
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献An asymmetric structure of bacterial TrpRS supports the half-of-the-sites catalytic mechanism and facilitates antimicrobial screening.
Nucleic Acids Res., 51, 2023

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