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4WIA
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Crystal structure of flagellar accessory protein FlaH from Methanocaldococcus jannaschii
分子名称: GLYCEROL, Putative flagella-related protein H, SULFATE ION
著者Meshcheryakov, V.A, Wolf, M.
登録日2014-09-25
公開日2015-10-07
最終更新日2020-02-05
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Crystal structure of the flagellar accessory protein FlaH of Methanocaldococcus jannaschii suggests a regulatory role in archaeal flagellum assembly.
Protein Sci., 25, 2016
8HQG
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BU of 8hqg by Molmil
Crystal structure of SARS-Cov-2 main protease K90R mutant in complex with inhibitor YH-53
分子名称: 3C-like proteinase nsp5, N-[(2S)-1-[[(2S)-1-(1,3-benzothiazol-2-yl)-1-oxidanylidene-3-[(3S)-2-oxidanylidenepyrrolidin-3-yl]propan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]-4-methoxy-1H-indole-2-carboxamide
著者Wang, J, Zhang, J, Li, J.
登録日2022-12-13
公開日2023-12-20
実験手法X-RAY DIFFRACTION (1.88 Å)
主引用文献Crystal structure of SARS-Cov-2 main protease K90R mutant in complex with inhibitor YH-53
To Be Published
4WIM
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BU of 4wim by Molmil
Crystal Structure of the GMP Synthetase from Plasmodium falciparum
分子名称: GMP synthetase
著者Ballut, L, Violot, S, Haser, R, Aghajari, N.
登録日2014-09-26
公開日2015-12-02
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (3.6 Å)
主引用文献Active site coupling in Plasmodium falciparum GMP synthetase is triggered by domain rotation.
Nat Commun, 6, 2015
8HRZ
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BU of 8hrz by Molmil
Crystal structure of the p97-N/D1 hexamer in complex with six p47-UBX domains
分子名称: ADENOSINE-5'-DIPHOSPHATE, NSFL1 cofactor p47, Transitional endoplasmic reticulum ATPase
著者Nguyen, T.Q, Kang, W.
登録日2022-12-16
公開日2023-12-20
最終更新日2024-05-29
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献Crystal structure of the p97-N/D1 hexmaer in complex with six p47-UBX domains
J. Korean Chem. Soc., 68, 2024
8HQ7
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BU of 8hq7 by Molmil
Cryo-EM structure of SARS-CoV-2 Omicron Prototype RBD in complex with fab L4.65 and L5.34
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Spike protein S1, fab L4.65, ...
著者Gao, G.F, Liu, S.
登録日2022-12-13
公開日2023-12-20
最終更新日2024-05-08
実験手法ELECTRON MICROSCOPY (2.7 Å)
主引用文献Dosing interval regimen shapes potency and breadth of antibody repertoire after vaccination of SARS-CoV-2 RBD protein subunit vaccine.
Cell Discov, 9, 2023
4WJ7
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CCM2 PTB domain in complex with KRIT1 NPxY/F3
分子名称: KRIT1 NPxY/F3, Malcavernin
著者Fisher, O.S, Liu, W, Zhang, R, Stiegler, A.L, Boggon, T.J.
登録日2014-09-29
公開日2014-12-24
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.753 Å)
主引用文献Structural Basis for the Disruption of the Cerebral Cavernous Malformations 2 (CCM2) Interaction with Krev Interaction Trapped 1 (KRIT1) by Disease-associated Mutations.
J.Biol.Chem., 290, 2015
8HQI
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BU of 8hqi by Molmil
Crystal structure of SARS-Cov-2 main protease P132H mutant in complex with inhibitor YH-53
分子名称: 3C-like proteinase nsp5, N-[(2S)-1-[[(2S)-1-(1,3-benzothiazol-2-yl)-1-oxidanylidene-3-[(3S)-2-oxidanylidenepyrrolidin-3-yl]propan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]-4-methoxy-1H-indole-2-carboxamide
著者Li, W.W, Zhang, J, Li, J.
登録日2022-12-13
公開日2023-12-20
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献Crystal structure of SARS-Cov-2 main protease P132H mutant in complex with inhibitor YH-53
To Be Published
4WJK
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BU of 4wjk by Molmil
Metal Ion and Ligand Binding of Integrin
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, CALCIUM ION, ...
著者Xia, W, Springer, T.A.
登録日2014-09-30
公開日2014-12-03
最終更新日2023-12-27
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Metal ion and ligand binding of integrin alpha 5 beta 1.
Proc.Natl.Acad.Sci.USA, 111, 2014
4WH3
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BU of 4wh3 by Molmil
N-acetylhexosamine 1-kinase in complex with ATP
分子名称: ACETIC ACID, ADENOSINE-5'-TRIPHOSPHATE, GLYCEROL, ...
著者Sato, M, Arakawa, T, Nam, Y.W, Nishimoto, M, Kitaoka, M, Fushinobu, S.
登録日2014-09-19
公開日2015-02-18
最終更新日2020-02-05
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Open-close structural change upon ligand binding and two magnesium ions required for the catalysis of N-acetylhexosamine 1-kinase
Biochim.Biophys.Acta, 1854, 2015
8HNA
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BU of 8hna by Molmil
Crystal structure of N-terminal fragment (20-221aa) of human SCARF1
分子名称: Scavenger receptor class F member 1
著者Wang, Y, He, Y, Li, G.
登録日2022-12-07
公開日2023-12-20
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Crystal structure of N-terminal of SCARF1 at 2.6 Angstroms resolution
To Be Published
4WH8
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BU of 4wh8 by Molmil
Crystal Structure of HCV NS3/4A protease in complex with an Asunaprevir P1-P3 macrocyclic analog.
分子名称: Genome polyprotein, SULFATE ION, ZINC ION, ...
著者Soumana, D.I, Ali, A, Schiffer, C.A.
登録日2014-09-20
公開日2014-10-15
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (2.703 Å)
主引用文献Structural Analysis of Asunaprevir Resistance in HCV NS3/4A Protease.
Acs Chem.Biol., 9, 2014
8HQH
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BU of 8hqh by Molmil
Crystal structure of SARS-Cov-2 main protease M49I mutant in complex with inhibitor YH-53
分子名称: 3C-like proteinase nsp5, N-[(2S)-1-[[(2S)-1-(1,3-benzothiazol-2-yl)-1-oxidanylidene-3-[(3S)-2-oxidanylidenepyrrolidin-3-yl]propan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]-4-methoxy-1H-indole-2-carboxamide
著者Zou, X.F, Zhang, J, Li, J.
登録日2022-12-13
公開日2023-12-20
実験手法X-RAY DIFFRACTION (1.58 Å)
主引用文献Crystal structure of SARS-Cov-2 main protease M49I mutant in complex with inhibitor YH-53
To Be Published
8HRM
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BU of 8hrm by Molmil
Cryo-EM structure of streptavidin
分子名称: Streptavidin
著者Xu, J, Liu, N, Wang, H.W.
登録日2022-12-15
公開日2023-12-20
実験手法ELECTRON MICROSCOPY (2.56 Å)
主引用文献Self-assembled monolayers guided free-standing atomic-crystal/molecule superstructure
To Be Published
4WHH
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BU of 4whh by Molmil
A New Class of Peptidomimetics Targeting the Polo-box Domain of Polo-like kinase 1
分子名称: C6H5(CH2)8-DERIVATIZED PEPTIDE INHIBITOR, SULFATE ION, Serine/threonine-protein kinase PLK1
著者Bang, J.K.
登録日2014-09-22
公開日2014-12-03
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献A new class of peptidomimetics targeting the polo-box domain of polo-like kinase 1.
J.Med.Chem., 58, 2015
8HQW
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BU of 8hqw by Molmil
The complex structure of COPI cargo sorting module with MHV Spike Hxx sorting motif
分子名称: Coatomer subunit beta',MHV Spike Hxx sorting motif
著者Ma, W.F, Nan, Y.N, Yang, M.R, Li, Y.Q.
登録日2022-12-14
公開日2023-12-20
実験手法X-RAY DIFFRACTION (1.405 Å)
主引用文献Tighter ER retention of SARS-CoV-2 Omicron spike caused by a constellation of folding disruptive mutations
To Be Published
4WHN
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BU of 4whn by Molmil
Structure of toxin-activating acyltransferase (TAAT)
分子名称: ApxC, CITRIC ACID
著者Crow, A, Greene, N.P, Hughes, C, Koronakis, V.
登録日2014-09-23
公開日2015-06-03
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.15 Å)
主引用文献Structure of a bacterial toxin-activating acyltransferase.
Proc.Natl.Acad.Sci.USA, 112, 2015
8HR4
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BU of 8hr4 by Molmil
[D-Cys5,D-Lys16]-STp(5-17)
分子名称: DCY-CYS-GLU-LEU-CYS-CYS-ASN-PRO-ALA-CYS-ALA-DLY-CYS
著者Shimamoto, S, Hidaka, Y, Yoshino, S, Goto, M.
登録日2022-12-14
公開日2023-12-20
実験手法SOLUTION NMR
主引用文献The molecular basis of heat-stable enterotoxin for vaccine development and cancer cell detection
To Be Published
4WK1
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BU of 4wk1 by Molmil
Crystal structure of Staphylococcus aureus PstA in complex with c-di-AMP
分子名称: (2R,3R,3aS,5R,7aR,9R,10R,10aS,12R,14aR)-2,9-bis(6-amino-9H-purin-9-yl)octahydro-2H,7H-difuro[3,2-d:3',2'-j][1,3,7,9,2,8 ]tetraoxadiphosphacyclododecine-3,5,10,12-tetrol 5,12-dioxide, CALCIUM ION, PstA
著者Mueller, M, Hopfner, K.-P, Witte, G.
登録日2014-10-01
公開日2014-11-26
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.98 Å)
主引用文献c-di-AMP recognition by Staphylococcus aureus PstA.
Febs Lett., 589, 2015
4WK3
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BU of 4wk3 by Molmil
Structure of Staphyloccus aureus PstA
分子名称: CHLORIDE ION, PstA
著者Mueller, M, Hopfner, K.-P, Witte, G.
登録日2014-10-01
公開日2014-11-26
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献c-di-AMP recognition by Staphylococcus aureus PstA.
Febs Lett., 589, 2015
8HRF
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BU of 8hrf by Molmil
Catalytic domain of Vibrio parahaemolyticus chitinase 1
分子名称: ACETATE ION, CALCIUM ION, Chitinase
著者Nakamura, A.
登録日2022-12-15
公開日2023-12-20
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Catalytic domain of Vibrio parahaemolyticus chitinase 1
To Be Published
4WK7
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BU of 4wk7 by Molmil
Crystal structure of human ADAMTS-4 in complex with inhibitor (compound 1, 2-(4-chlorophenoxy)-N-{[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]methyl} acetamide)
分子名称: 2-(4-chlorophenoxy)-N-{[(4R)-4-methyl-2,5-dioxoimidazolidin-4-yl]methyl}acetamide, A disintegrin and metalloproteinase with thrombospondin motifs 4, CALCIUM ION, ...
著者Durbin, J.D, Stout, S.L.
登録日2014-10-01
公開日2014-12-10
最終更新日2024-10-09
実験手法X-RAY DIFFRACTION (1.24 Å)
主引用文献Identification of potent and selective hydantoin inhibitors of aggrecanase-1 and aggrecanase-2 that are efficacious in both chemical and surgical models of osteoarthritis.
J.Med.Chem., 57, 2014
8HPB
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BU of 8hpb by Molmil
NMR Structure of OsCIE1-Ubox S237D mutant
分子名称: U-box domain-containing protein 12
著者Zhang, Y, Yu, C.Z, Lan, W.X.
登録日2022-12-12
公開日2023-12-20
最終更新日2024-06-12
実験手法SOLUTION NMR
主引用文献Release of a ubiquitin brake activates OsCERK1-triggered immunity in rice.
Nature, 629, 2024
4WKC
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Crystal structure of Escherichia coli 5'-methylthioadenosine/S-adenosyl homocysteine nucleosidase (MTAN) complexed with butylthio-DADMe-Immucillin-A
分子名称: (3R,4S)-1-[(4-amino-5H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-[(butylsulfanyl)methyl]pyrrolidin-3-ol, 5'-methylthioadenosine/S-adenosylhomocysteine nucleosidase, TETRAETHYLENE GLYCOL
著者Cameron, S.A, Thomas, K, Almo, S.C, Schramm, V.L.
登録日2014-10-02
公開日2015-08-19
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (1.64 Å)
主引用文献Active site and remote contributions to catalysis in methylthioadenosine nucleosidases.
Biochemistry, 54, 2015
8HRK
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SARS-CoV-2 Delta S-RBD-ACE2 complex
分子名称: Processed angiotensin-converting enzyme 2, Spike protein S1
著者Xu, J, Meng, F, Liu, N, Wang, H.W.
登録日2022-12-15
公開日2023-12-20
実験手法ELECTRON MICROSCOPY (3.3 Å)
主引用文献Self-assembled monolayers guided free-standing atomic-crystal/molecule superstructure
To Be Published
4WHU
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BU of 4whu by Molmil
BROMO domain of CREB binding protein
分子名称: 2-methoxy-4-{1-[2-(morpholin-4-yl)ethyl]-2-(2-phenylethyl)-1H-benzimidazol-5-yl}cyclohepta-2,4,6-trien-1-one, CREB-binding protein
著者Liu, S.
登録日2014-09-23
公開日2015-10-28
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.11 Å)
主引用文献Direct photocapture of bromodomains using tropolone chemical probes
To Be Published

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