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7SF3
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SARS-CoV-2 Main Protease (Mpro) in Complex with ML1006m
分子名称: (1R,2S,5S)-N-{(2S,3R)-3-hydroxy-4-(methylamino)-4-oxo-1-[(3S)-2-oxopyrrolidin-3-yl]butan-2-yl}-6,6-dimethyl-3-[3-methyl-N-(trifluoroacetyl)-L-valyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide, 3C-like proteinase, CHLORIDE ION
著者Westberg, M, Fernandez, D, Lin, M.Z.
登録日2021-10-02
公開日2022-10-05
最終更新日2024-04-17
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献An orally bioavailable SARS-CoV-2 main protease inhibitor exhibits improved affinity and reduced sensitivity to mutations.
Sci Transl Med, 16, 2024
7SFH
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SARS-CoV-2 Main Protease (Mpro) in Complex with ML102
分子名称: (1R,2S,5S)-N-{(2S,3R)-4-amino-3-hydroxy-4-oxo-1-[(3S)-2-oxopyrrolidin-3-yl]butan-2-yl}-6,6-dimethyl-3-(3-phenylpropanoyl)-3-azabicyclo[3.1.0]hexane-2-carboxamide, 3C-like proteinase, CALCIUM ION
著者Westberg, M, Fernandez, D, Lin, M.Z.
登録日2021-10-03
公開日2022-10-05
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Rational design of a new class of protease inhibitors for the potential treatment of coronavirus diseases
To Be Published
7SET
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SARS-CoV-2 Main Protease (Mpro) in Complex with ML1000
分子名称: (1R,2S,5S)-N-{(2S,3R)-4-amino-3-hydroxy-4-oxo-1-[(3S)-2-oxopyrrolidin-3-yl]butan-2-yl}-3-[N-(tert-butylcarbamoyl)-3-methyl-L-valyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide, 3C-like proteinase, CHLORIDE ION
著者Westberg, M, Fernandez, D, Lin, M.Z.
登録日2021-10-01
公開日2022-10-05
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献An orally bioavailable SARS-CoV-2 main protease inhibitor exhibits improved affinity and reduced sensitivity to mutations.
Sci Transl Med, 16, 2024
8R8R
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Cryo-EM structure of the human mPSF with PAPOA C-terminus peptide (PAPOAc)
分子名称: Cleavage and polyadenylation specificity factor subunit 1, Cleavage and polyadenylation specificity factor subunit 4, RNA (5'-R(P*AP*AP*UP*AP*AP*A)-3'), ...
著者Todesca, S, Sandmeir, F, Keidel, A, Conti, E.
登録日2023-11-29
公開日2024-04-10
最終更新日2024-06-26
実験手法ELECTRON MICROSCOPY (2.79 Å)
主引用文献Molecular basis of human poly(A) polymerase recruitment by mPSF.
Rna, 30, 2024
8G1L
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Lectin domain of Aap (Staphylococcus epidermidis Accumulation Associated Protein)
分子名称: 2-(2-METHOXYETHOXY)ETHANOL, Accumulation associated protein, CALCIUM ION, ...
著者Maciag, J.J, Herr, A.B.
登録日2023-02-02
公開日2024-02-14
実験手法X-RAY DIFFRACTION (1.06 Å)
主引用文献Mechanistic basis of staphylococcal interspecies competition for skin colonization
To Be Published
2LXN
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Solution NMR structure of glutamine amido transferase subunit of gaunosine monophosphate synthetase from Methanocaldococcus jannaschii
分子名称: GMP synthase [glutamine-hydrolyzing] subunit A
著者Ali, R, Kumar, S, Balaram, H, Sarma, S.P.
登録日2012-08-30
公開日2013-06-12
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献1H, 13C, 15N assignment and secondary structure determination of glutamine amido transferase subunit of gaunosine monophosphate synthetase from Methanocaldococcus jannaschii
Biomol.Nmr Assign., 6, 2012
6XYP
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Multiple system atrophy Type II-1 alpha-synuclein filament
分子名称: Alpha-synuclein
著者Schweighauser, M, Shi, Y, Tarutani, A, Kametani, F, Murzin, A.G, Ghetti, B, Matsubara, T, Tomita, T, Ando, T, Hasegawa, K, Murayama, S, Yoshida, M, Hasegawa, M, Scheres, S.H.W, Goedert, M.
登録日2020-01-30
公開日2020-02-12
最終更新日2024-05-22
実験手法ELECTRON MICROSCOPY (3.29 Å)
主引用文献Structures of alpha-synuclein filaments from multiple system atrophy.
Nature, 585, 2020
6XYQ
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Multiple system atrophy Type II-2 alpha-synuclein filament
分子名称: Alpha-synuclein
著者Schweighauser, M, Shi, Y, Tarutani, A, Kametani, F, Murzin, A.G, Ghetti, B, Matsubara, T, Tomita, T, Ando, T, Hasegawa, K, Murayama, S, Yoshida, M, Hasegawa, M, Scheres, S.H.W, Goedert, M.
登録日2020-01-30
公開日2020-02-12
最終更新日2024-05-22
実験手法ELECTRON MICROSCOPY (3.09 Å)
主引用文献Structures of alpha-synuclein filaments from multiple system atrophy.
Nature, 585, 2020
6SPG
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Pseudomonas aeruginosa 70s ribosome from a clinical isolate
分子名称: 16S ribosomal RNA, 23S ribosomal RNA, 30S ribosomal protein S10, ...
著者Halfon, Y, Jimenez-Fernande, A, La Ros, R, Espinos, R, Krogh Johansen, H, Matzov, D, Eyal, Z, Bashan, A, Zimmerman, E, Belousoff, M, Molin, S, Yonath, A.
登録日2019-09-01
公開日2019-10-16
最終更新日2019-11-06
実験手法ELECTRON MICROSCOPY (3.34 Å)
主引用文献Structure ofPseudomonas aeruginosaribosomes from an aminoglycoside-resistant clinical isolate.
Proc.Natl.Acad.Sci.USA, 116, 2019
4GXH
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Crystal Structure of a Pyrrolidone-carboxylate peptidase 1 (target ID NYSGRC-012831) from Xenorhabdus bovienii SS-2004
分子名称: CHLORIDE ION, PHOSPHATE ION, Pyrrolidone-carboxylate peptidase
著者Ghosh, A, Almo, S.C, New York Structural Genomics Research Consortium (NYSGRC)
登録日2012-09-04
公開日2012-09-19
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献Crystal Structure of a Pyrrolidone-carboxylate peptidase 1 (target ID NYSGRC-012831) from Xenorhabdus bovienii SS-2004 (CASP Target)
To be Published
8CLR
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BU of 8clr by Molmil
Integrated NMR/MD structure determination of a dynamic and thermodynamically stable CUUG RNA tetraloop
分子名称: RNA hairpin with CUUG tetraloop
著者Oxenfarth, A, Kuemmerer, F, Bottaro, S, Schnieders, R, Pinter, G, Jonker, H.R.A, Fuertig, B, Richter, C, Blackledge, M, Lindorff-Larsen, K, Schwalbe, H.
登録日2023-02-17
公開日2023-07-19
最終更新日2024-06-19
実験手法SOLUTION NMR
主引用文献Integrated NMR/Molecular Dynamics Determination of the Ensemble Conformation of a Thermodynamically Stable CUUG RNA Tetraloop.
J.Am.Chem.Soc., 145, 2023
7BOT
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Human SIRT2 in complex with myristoyl thiourea inhibitor, No.23
分子名称: N-dodecylmethanethioamide, NAD-dependent protein deacetylase sirtuin-2, ZINC ION, ...
著者Kudo, N, Olsen, C.A, Minoru, Y.
登録日2020-03-19
公開日2021-03-24
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Mechanism-based inhibitors of SIRT2: structure-activity relationship, X-ray structures, target engagement, regulation of alpha-tubulin acetylation and inhibition of breast cancer cell migration.
Rsc Chem Biol, 2, 2021
6RPP
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Crystal structure of PabCDC21-1 intein
分子名称: ACETATE ION, Cell division control protein, DI(HYDROXYETHYL)ETHER
著者Mikula, K.M, Beyer, H.M, Iwai, H.
登録日2019-05-14
公開日2019-08-14
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Crystal structures of CDC21-1 inteins from hyperthermophilic archaea reveal the selection mechanism for the highly conserved homing endonuclease insertion site.
Extremophiles, 23, 2019
6RPQ
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Crystal structure of PhoCDC21-1 intein
分子名称: Ubiquitin-like protein SMT3,1108aa long hypothetical cell division control protein
著者Beyer, H.M, Mikula, K.M, Iwai, H.
登録日2019-05-14
公開日2019-08-14
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (2.654 Å)
主引用文献Crystal structures of CDC21-1 inteins from hyperthermophilic archaea reveal the selection mechanism for the highly conserved homing endonuclease insertion site.
Extremophiles, 23, 2019
7BOS
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BU of 7bos by Molmil
Human SIRT2 in complex with myristoyl thiourea inhibitor, No.13
分子名称: Myristoyl thiourea inhibitor, No.13, N-dodecylmethanethioamide, ...
著者Kudo, N, Olsen, C.A, Minoru, Y.
登録日2020-03-19
公開日2021-03-24
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Mechanism-based inhibitors of SIRT2: structure-activity relationship, X-ray structures, target engagement, regulation of alpha-tubulin acetylation and inhibition of breast cancer cell migration.
Rsc Chem Biol, 2, 2021
9G8R
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human SKI7-SKI238 complex in the open state
分子名称: Isoform 2 of HBS1-like protein, Superkiller complex protein 2, Superkiller complex protein 3, ...
著者Koegel, A, Keidel, A, Loukeri, M.J, Kuhn, C.C, Langer, L.M, Schaefer, I.B, Conti, E.
登録日2024-07-23
公開日2024-10-16
実験手法ELECTRON MICROSCOPY (3.4 Å)
主引用文献Structural basis of mRNA decay by the human exosome-ribosome supercomplex
Nature, 2024
9G8Q
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40S-bound human SKI238 complex in the open state (Gatekeeping module)
分子名称: Helicase SKI2W, Superkiller complex protein 3, WD repeat-containing protein 61
著者Koegel, A, Keidel, A, Loukeri, M.J, Kuhn, C.C, Langer, L.M, Schaefer, I.B, Conti, E.
登録日2024-07-23
公開日2024-10-16
実験手法ELECTRON MICROSCOPY (4.1 Å)
主引用文献Structural basis of mRNA decay by the human exosome-ribosome supercomplex
Nature, 2024
9G8N
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80S-bound human Ski2-exosome complex
分子名称: CrPV-IRES RNA, DIS3-like exonuclease 1, Exosome complex component CSL4, ...
著者Koegel, A, Keidel, A, Loukeri, M.J, Kuhn, C.C, Langer, L.M, Schaefer, I.B, Conti, E.
登録日2024-07-23
公開日2024-10-16
実験手法ELECTRON MICROSCOPY (3.7 Å)
主引用文献Structural basis of mRNA decay by the human exosome-ribosome supercomplex
Nature, 2024
9G8P
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40S-bound human SKI2-exosome complex
分子名称: CrPV-IRES RNA, DIS3-like exonuclease 1, Exosome complex component CSL4, ...
著者Koegel, A, Keidel, A, Loukeri, M.J, Kuhn, C.C, Langer, L.M, Schaefer, I.B, Conti, E.
登録日2024-07-23
公開日2024-10-16
実験手法ELECTRON MICROSCOPY (7 Å)
主引用文献Structural basis of mRNA decay by the human exosome-ribosome supercomplex
Nature, 2024
9G8O
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human 40S ribosome bound by a SKI238-exosome complex
分子名称: 18S ribosomal RNA, 40S ribosomal protein S10, 40S ribosomal protein S11, ...
著者Koegel, A, Keidel, A, Loukeri, M.J, Kuhn, C.C, Langer, L.M, Schaefer, I.B, Conti, E.
登録日2024-07-23
公開日2024-10-16
実験手法ELECTRON MICROSCOPY (3.4 Å)
主引用文献Structural basis of mRNA decay by the human exosome-ribosome supercomplex
Nature, 2024
7U92
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SARS-CoV-2 Main Protease (Mpro) in Complex with ML1006a
分子名称: (1R,2S,5S)-N-{(2S,3R)-4-(azetidin-1-yl)-3-hydroxy-4-oxo-1-[(3S)-2-oxopyrrolidin-3-yl]butan-2-yl}-6,6-dimethyl-3-[3-methyl-N-(trifluoroacetyl)-L-valyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide, 3C-like proteinase, CHLORIDE ION
著者Westberg, M, Fernandez, D, Lin, M.Z.
登録日2022-03-09
公開日2023-09-06
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献An orally bioavailable SARS-CoV-2 main protease inhibitor exhibits improved affinity and reduced sensitivity to mutations.
Sci Transl Med, 16, 2024
7UUG
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SARS-CoV-2 Main Protease S144A (Mpro S144A) in Complex with ML1006a
分子名称: (1R,2S,5S)-N-{(2S,3R)-4-(azetidin-1-yl)-3-hydroxy-4-oxo-1-[(3S)-2-oxopyrrolidin-3-yl]butan-2-yl}-6,6-dimethyl-3-[3-methyl-N-(trifluoroacetyl)-L-valyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide, 3C-like proteinase nsp5, CHLORIDE ION
著者Westberg, M, Fernandez, D, Lin, M.Z.
登録日2022-04-28
公開日2023-10-11
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献An orally bioavailable SARS-CoV-2 main protease inhibitor exhibits improved affinity and reduced sensitivity to mutations.
Sci Transl Med, 16, 2024
7UUP
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SARS-CoV-2 Main Protease S144A (Mpro S144A) in Complex with Nirmatrelvir (PF-07321332)
分子名称: (1R,2S,5S)-N-{(1E,2S)-1-imino-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-6,6-dimethyl-3-[3-methyl-N-(trifluoroacetyl)-L-valyl]-3-azabicyclo[3.1.0]hexane-2-carboxamide, 3C-like proteinase nsp5, CHLORIDE ION
著者Westberg, M, Fernandez, D, Lin, M.Z.
登録日2022-04-28
公開日2023-10-11
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献An orally bioavailable SARS-CoV-2 main protease inhibitor exhibits improved affinity and reduced sensitivity to mutations.
Sci Transl Med, 16, 2024
8PK0
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human mitoribosomal large subunit assembly intermediate 1 with GTPBP10-GTPBP7
分子名称: 16S rRNA + pre-H68-71 segment, 39S ribosomal protein L10, mitochondrial, ...
著者Kummer, E, Nguyen, T.G, Ritter, C.
登録日2023-06-23
公開日2023-12-13
最終更新日2024-06-26
実験手法ELECTRON MICROSCOPY (3.03 Å)
主引用文献Structural insights into the role of GTPBP10 in the RNA maturation of the mitoribosome.
Nat Commun, 14, 2023
8RB4
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Structure of the five-fold capsomer of the PNMA2 capsid
分子名称: Paraneoplastic antigen Ma2 homolog
著者Erlendsson, S, Xu, J, Shepherd, J.D, Briggs, J.A.G.
登録日2023-12-02
公開日2024-02-14
最終更新日2024-02-28
実験手法ELECTRON MICROSCOPY (3.2 Å)
主引用文献PNMA2 forms immunogenic non-enveloped virus-like capsids associated with paraneoplastic neurological syndrome.
Cell, 187, 2024

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件を2024-10-16に公開中

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