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7XZE
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BU of 7xze by Molmil
Mutant (H176A) of the N-terminal domain of fucoidan lyase FdlA
分子名称: Fucoidan lyase, IMIDAZOLE, SULFATE ION
著者Wang, J, Li, M, Pan, X.
登録日2022-06-02
公開日2022-09-28
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Structural and Biochemical Analysis Reveals Catalytic Mechanism of Fucoidan Lyase from Flavobacterium sp. SA-0082.
Mar Drugs, 20, 2022
7XZ7
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BU of 7xz7 by Molmil
Mutant (D137A) of the N-terminal domain of fucoidan lyase FdlA
分子名称: Fucoidan lyase
著者Wang, J, Li, M, Pan, X.
登録日2022-06-02
公開日2022-09-28
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.98 Å)
主引用文献Structural and Biochemical Analysis Reveals Catalytic Mechanism of Fucoidan Lyase from Flavobacterium sp. SA-0082.
Mar Drugs, 20, 2022
6PAG
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BU of 6pag by Molmil
Killer cell immunoglobulin-like receptor 2DL3 in complex with HLA-C*07:02
分子名称: ARG-TYR-ARG-PRO-GLY-THR-VAL-ALA-LEU, Beta-2-microglobulin, HLA class I histocompatibility antigen, ...
著者Moradi, S, Rossjohn, J, Vivian, J.P.
登録日2019-06-11
公開日2020-12-16
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.501 Å)
主引用文献Structural plasticity of KIR2DL2 and KIR2DL3 enables altered docking geometries atop HLA-C.
Nat Commun, 12, 2021
7XZC
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BU of 7xzc by Molmil
Mutant (R240A) of the N-terminal domain of fucoidan lyase FdlA
分子名称: Fucoidan lyase
著者Wang, J, Li, M, Pan, X.
登録日2022-06-02
公開日2022-09-28
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Structural and Biochemical Analysis Reveals Catalytic Mechanism of Fucoidan Lyase from Flavobacterium sp. SA-0082.
Mar Drugs, 20, 2022
6BSC
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BU of 6bsc by Molmil
Crystal structure of the Mucin-1 SEA domain
分子名称: Mucin-1
著者Noguera, M.E, Jakoncic, J, Ermacora, M.R.
登録日2017-12-01
公開日2018-12-05
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (1.303 Å)
主引用文献High-resolution structure of intramolecularly proteolyzed human mucin-1 SEA domain.
Biochim Biophys Acta Proteins Proteom, 1868, 2020
6PIU
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BU of 6piu by Molmil
Crystal structure of HCV NS3/4A D168A protease in complex with P4-P5-6 (NR03-68)
分子名称: 1,2-ETHANEDIOL, NS3 protease, ZINC ION, ...
著者Zephyr, J, Schiffer, C.A.
登録日2019-06-27
公開日2020-03-04
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.28 Å)
主引用文献Avoiding Drug Resistance by Substrate Envelope-Guided Design: Toward Potent and Robust HCV NS3/4A Protease Inhibitors.
Mbio, 11, 2020
6PIY
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BU of 6piy by Molmil
Crystal structure of HCV NS3/4A D168A protease in complex with P4-2 (NR02-61)
分子名称: 1,2-ETHANEDIOL, 1-methylcyclobutyl [(2R,6S,12Z,13aS,14aR,16aS)-2-[(7-methoxy-3-methylquinoxalin-2-yl)oxy]-14a-{[(1-methylcyclopropyl)sulfonyl]carbamoyl}-5,16-dioxo-1,2,3,5,6,7,8,9,10,11,13a,14,14a,15,16,16a-hexadecahydrocyclopropa[e]pyrrolo[1,2-a][1,4]diazacyclopentadecin-6-yl]carbamate, NS3/4A protease, ...
著者Zephyr, J, Schiffer, C.A.
登録日2019-06-27
公開日2020-03-04
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.862 Å)
主引用文献Avoiding Drug Resistance by Substrate Envelope-Guided Design: Toward Potent and Robust HCV NS3/4A Protease Inhibitors.
Mbio, 11, 2020
6PA1
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BU of 6pa1 by Molmil
Killer cell immunoglobulin-like receptor 2DL2 in complex with HLA-C*07:02
分子名称: ARG-TYR-ARG-PRO-GLY-THR-VAL-ALA-LEU, Beta-2-microglobulin, HLA class I histocompatibility antigen, ...
著者Moradi, S, Rossjohn, J, Vivian, J.P.
登録日2019-06-11
公開日2020-12-16
最終更新日2024-10-09
実験手法X-RAY DIFFRACTION (3.01 Å)
主引用文献Structural plasticity of KIR2DL2 and KIR2DL3 enables altered docking geometries atop HLA-C.
Nat Commun, 12, 2021
7RX4
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BU of 7rx4 by Molmil
Cryo-EM reconstruction of AS2 nanotube (Form II like)
分子名称: AS2 peptide
著者Wang, F, Gnewou, O.M, Solemanifar, A, Xu, C, Egelman, E.H, Conticello, V.P.
登録日2021-08-21
公開日2021-09-08
最終更新日2024-06-05
実験手法ELECTRON MICROSCOPY (3.8 Å)
主引用文献Cryo-EM of Helical Polymers.
Chem.Rev., 122, 2022
7RX5
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BU of 7rx5 by Molmil
Cryo-EM reconstruction of Form1-N2 nanotube (Form I like)
分子名称: F1-N2 nanotube
著者Wang, F, Gnewou, O.M, Solemanifar, A, Xu, C, Egelman, E.H, Conticello, V.P.
登録日2021-08-21
公開日2021-09-08
最終更新日2024-06-05
実験手法ELECTRON MICROSCOPY (3.4 Å)
主引用文献Cryo-EM of Helical Polymers.
Chem.Rev., 122, 2022
5LMF
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BU of 5lmf by Molmil
Structure of C-terminal domain from S. cerevisiae Pat1 decapping activator bound to Dcp2 HLM3 peptide (region 484-500)
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, DNA topoisomerase 2-associated protein PAT1, ...
著者Charenton, C, Gaudon-Plesse, C, Fourati, Z, Taverniti, V, Back, R, Kolesnikova, O, Seraphin, B, Graille, M.
登録日2016-07-30
公開日2017-08-16
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.15 Å)
主引用文献A unique surface on Pat1 C-terminal domain directly interacts with Dcp2 decapping enzyme and Xrn1 5'-3' mRNA exonuclease in yeast.
Proc. Natl. Acad. Sci. U.S.A., 114, 2017
6PQA
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BU of 6pqa by Molmil
GAVVGG segment 119-124 from human prion
分子名称: Major prion protein
著者Apostol, M.I, Sawaya, M.R, Eisenberg, D.
登録日2019-07-08
公開日2020-04-15
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (1.46 Å)
主引用文献Cryo-EM structure of a human prion fibril with a hydrophobic, protease-resistant core.
Nat.Struct.Mol.Biol., 27, 2020
6MM9
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BU of 6mm9 by Molmil
Diheteromeric NMDA receptor GluN1/GluN2A in the '1-Knuckle' conformation, in complex with glycine and glutamate, in the presence of 1 micromolar zinc chloride, and at pH 6.1
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, Glutamate receptor ionotropic, NMDA 1, ...
著者Jalali-Yazdi, F, Chowdhury, S, Yoshioka, C, Gouaux, E.
登録日2018-09-29
公開日2018-11-28
最終更新日2020-07-29
実験手法ELECTRON MICROSCOPY (5.97 Å)
主引用文献Mechanisms for Zinc and Proton Inhibition of the GluN1/GluN2A NMDA Receptor.
Cell, 175, 2018
6MMU
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BU of 6mmu by Molmil
Triheteromeric NMDA receptor GluN1/GluN2A/GluN2A* in the '2-Knuckle-Asymmetric' conformation, in complex with glycine and glutamate, in the presence of 1 micromolar zinc chloride, and at pH 7.4
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Glutamate receptor ionotropic, ...
著者Jalali-Yazdi, F, Chowdhury, S, Yoshioka, C, Gouaux, E.
登録日2018-10-01
公開日2018-11-28
最終更新日2020-07-29
実験手法ELECTRON MICROSCOPY (5.3 Å)
主引用文献Mechanisms for Zinc and Proton Inhibition of the GluN1/GluN2A NMDA Receptor.
Cell, 175, 2018
6PIX
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BU of 6pix by Molmil
Crystal structure of HCV NS3/4A D168A protease in complex with P4-P5-5 (WK-25)
分子名称: 1,2-ETHANEDIOL, NS3/4A protease, SULFATE ION, ...
著者Zephyr, J, Schiffer, C.A.
登録日2019-06-27
公開日2020-03-04
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.87 Å)
主引用文献Avoiding Drug Resistance by Substrate Envelope-Guided Design: Toward Potent and Robust HCV NS3/4A Protease Inhibitors.
Mbio, 11, 2020
5W5X
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BU of 5w5x by Molmil
Crystal structure of BAXP168G in complex with an activating antibody
分子名称: 1,2-ETHANEDIOL, 3C10 Fab' heavy chain, 3C10 Fab' light chain, ...
著者Robin, A.Y, Colman, P.M, Czabotar, P.E.
登録日2017-06-16
公開日2018-06-27
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.502 Å)
主引用文献Ensemble Properties of Bax Determine Its Function.
Structure, 26, 2018
5LTD
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BU of 5ltd by Molmil
Phosphate-bound Pichia angusta Atg18
分子名称: 1,2-ETHANEDIOL, Autophagy-related protein 18, PHOSPHATE ION
著者Scacioc, A, Kuhnel, K.
登録日2016-09-06
公開日2017-09-20
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Phopshate-bound Pichia angusta Atg18
To Be Published
5LY3
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BU of 5ly3 by Molmil
P. calidifontis crenactin in complex with arcadin-2 C-terminal peptide
分子名称: ADENOSINE-5'-DIPHOSPHATE, Actin-like protein, Actin/actin family protein
著者Izore, T, Lowe, J.
登録日2016-09-23
公開日2016-11-30
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Crenactin forms actin-like double helical filaments regulated by arcadin-2.
Elife, 5, 2016
6CU2
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BU of 6cu2 by Molmil
Structure of N-truncated R2-type pyocin tail fiber at 2.6 angstrom resolution
分子名称: MAGNESIUM ION, NICKEL (II) ION, R2-type pyocin
著者Salazar, A.J, Sherekar, M, Saccettini, J.C.
登録日2018-03-23
公開日2019-02-20
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.58 Å)
主引用文献R pyocin tail fiber structure reveals a receptor-binding domain with a lectin fold.
PLoS ONE, 14, 2019
6D0S
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BU of 6d0s by Molmil
RabGAP domain of human TBC1D22B
分子名称: SULFATE ION, TBC1 domain family member 22B, UNKNOWN ATOM OR ION
著者Tong, Y, Tempel, W, Arrowsmith, C.H, Edwards, A.M, Bountra, C, Park, H, Structural Genomics Consortium (SGC)
登録日2018-04-10
公開日2018-06-06
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献RabGAP domain of human TBC1D22B
To be Published
5LS7
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BU of 5ls7 by Molmil
Complex of wild type E. coli alpha aspartate decarboxylase with its processing factor PanZ
分子名称: ACETYL COENZYME *A, Aspartate 1-decarboxylase, CARBON DIOXIDE, ...
著者Monteiro, D.C.F, Webb, M.E, Pearson, A.R.
登録日2016-08-22
公開日2017-09-13
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.16 Å)
主引用文献The Mechanism of Regulation of Pantothenate Biosynthesis by the PanD-PanZAcCoA Complex Reveals an Additional Mode of Action for the Antimetabolite N-Pentyl Pantothenamide (N5-Pan).
Biochemistry, 56, 2017
4WZK
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BU of 4wzk by Molmil
Crystal structure of P domain from norovirus strain Saga4 in complex with HBGA type H2 (triglycan)
分子名称: ACETATE ION, VP1, alpha-L-fucopyranose-(1-2)-beta-D-galactopyranose-(1-4)-2-acetamido-2-deoxy-alpha-D-glucopyranose
著者Singh, B.K, Hansman, G.S.
登録日2014-11-20
公開日2014-12-17
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.49 Å)
主引用文献Human noroviruses' fondness for histo-blood group antigens.
J.Virol., 89, 2015
4WZT
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BU of 4wzt by Molmil
Crystal structure of P domain from norovirus strain NSW0514 in complex with HBGA type A (triglycan)
分子名称: 1,2-ETHANEDIOL, VP1, alpha-L-fucopyranose-(1-2)-[2-acetamido-2-deoxy-alpha-D-galactopyranose-(1-3)]alpha-D-galactopyranose
著者Singh, B.K, Hansman, G.S.
登録日2014-11-20
公開日2014-12-17
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.91 Å)
主引用文献Human noroviruses' fondness for histo-blood group antigens.
J.Virol., 89, 2015
4WZL
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BU of 4wzl by Molmil
Crystal structure of P domain from norovirus strain Saga4 in complex with HBGA type Lea (triglycan)
分子名称: 1,2-ETHANEDIOL, ACETATE ION, VP1, ...
著者Singh, B.K, Hansman, G.S.
登録日2014-11-20
公開日2014-12-17
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Human noroviruses' fondness for histo-blood group antigens.
J.Virol., 89, 2015
7B3E
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BU of 7b3e by Molmil
Crystal structure of myricetin covalently bound to the main protease (3CLpro/Mpro) of SARS-CoV-2
分子名称: 1,2-ETHANEDIOL, 3,5,7-TRIHYDROXY-2-(3,4,5-TRIHYDROXYPHENYL)-4H-CHROMEN-4-ONE, CHLORIDE ION, ...
著者Costanzi, E, Demitri, N, Giabbai, B, Storici, P.
登録日2020-11-30
公開日2021-01-13
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.77 Å)
主引用文献Identification of Inhibitors of SARS-CoV-2 3CL-Pro Enzymatic Activity Using a Small Molecule in Vitro Repurposing Screen.
Acs Pharmacol Transl Sci, 4, 2021

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