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9MGY
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BU of 9mgy by Molmil
Cryo-EM structure of Human NLRP3 complex with compound 1
分子名称: (2M)-2-(6-{[(3R)-1-methylpiperidin-3-yl]amino}pyridazin-3-yl)-5-(trifluoromethyl)phenol, ADENOSINE-5'-TRIPHOSPHATE, NACHT, ...
著者Mammoliti, O, Carbajo, R.J, Perez-Benito, L, Yu, X, Prieri, M.L.C, Bontempi, L, Embrechts, S, Paesmans, I, Bassi, M, Bhattacharya, A, Roman, S.C, Hoog, S.D, Demin, S, Gijsen, H.J.M, Hache, G, Jacobs, T, Jerhaoui, S, Leenaerts, J, Lutter, F.H, Matico, R, Oehlrich, D, Perrier, M, Ryabchuk, P, Schepens, W, Sharma, S, Somers, M, Suarez, J, Surkyn, M, Opdenbosch, N.V, Verhulst, T, Bottelbergs, A.
登録日2024-12-11
公開日2025-02-26
最終更新日2025-03-12
実験手法ELECTRON MICROSCOPY (2.9 Å)
主引用文献Discovery of Potent and Brain-Penetrant Bicyclic NLRP3 Inhibitors with Peripheral and Central In Vivo Activity.
J.Med.Chem., 68, 2025
9MIG
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BU of 9mig by Molmil
Cryo-EM structure of Human NLRP3 complex with compound 3
分子名称: (2P)-2-(4-{[(3R)-1-methylpiperidin-3-yl]amino}-5,6,7,8-tetrahydrophthalazin-1-yl)-5-(trifluoromethyl)phenol, ADENOSINE-5'-TRIPHOSPHATE, NACHT, ...
著者Mammoliti, O, Carbajo, R.J, Perez-Benito, L, Yu, X, Prieri, M.L.C, Bontempi, L, Embrechts, S, Paesmans, I, Bassi, M, Bhattacharya, A, Roman, S.C, Hoog, S.D, Demin, S, Gijsen, H.J.M, Hache, G, Jacobs, T, Jerhaoui, S, Leenaerts, J, Lutter, F.H, Matico, R, Oehlrich, D, Perrier, M, Ryabchuk, P, Schepens, W, Sharma, S, Somers, M, Suarez, J, Surkyn, M, Opdenbosch, N.V, Verhulst, T, Bottelbergs, A.
登録日2024-12-12
公開日2025-02-26
最終更新日2025-03-12
実験手法ELECTRON MICROSCOPY (3.6 Å)
主引用文献Discovery of Potent and Brain-Penetrant Bicyclic NLRP3 Inhibitors with Peripheral and Central In Vivo Activity.
J.Med.Chem., 68, 2025
2G9J
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BU of 2g9j by Molmil
Complex of TM1a(1-14)Zip with TM9a(251-284): a model for the polymerization domain ("overlap region") of tropomyosin, Northeast Structural Genomics Target OR9
分子名称: Tropomyosin 1 alpha chain, Tropomyosin 1 alpha chain/General control protein GCN4
著者Greenfield, N.J, Huang, Y.J, Swapna, G.V.T, Bhattacharya, A, Singh, A, Montelione, G.T, Hitchcock-DeGregori, S.E, Northeast Structural Genomics Consortium (NESG)
登録日2006-03-06
公開日2006-11-07
最終更新日2024-05-29
実験手法SOLUTION NMR
主引用文献Solution NMR Structure of the Junction between Tropomyosin Molecules: Implications for Actin Binding and Regulation.
J.Mol.Biol., 364, 2006
6C68
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BU of 6c68 by Molmil
MHC-independent t cell receptor A11
分子名称: T-cell receptor alpha chain, T-cell receptor beta chain
著者Lu, J, Van Laethem, F, Saba, I, Chu, J, Bhattacharya, A, Love, N.C, Tikhonova, A, Radaev, S, Sun, X, Ko, A, Arnon, T, Shifrut, E, Friedman, N, Weng, N, Singer, A, Sun, P.D.
登録日2018-01-18
公開日2019-01-30
最終更新日2024-10-23
実験手法X-RAY DIFFRACTION (2.59 Å)
主引用文献Structure of MHC-Independent TCRs and Their Recognition of Native Antigen CD155.
J Immunol., 204, 2020
4KUJ
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BU of 4kuj by Molmil
Structural and functional characterization of a novel Alpha Kinase from Entamoeba histolytica
分子名称: DI(HYDROXYETHYL)ETHER, Protein kinase, putative, ...
著者Rehman, S.A.A, Tarique, K.F, Bhattacharya, A, Gourinath, S, Mansuri, M.S.
登録日2013-05-22
公開日2014-05-28
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (1.99 Å)
主引用文献Structural and functional characterization of a novel Alpha Kinase from Entamoeba histolytica
To be Published
5XYL
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BU of 5xyl by Molmil
Solution Structure of Skp1 from Homo sapiens
分子名称: S-phase kinase-associated protein 1
著者Shukla, V.K, Kachariya, N.N, Bhattacharya, A, Dantu, S.C, Kumar, A.
登録日2017-07-09
公開日2018-07-11
最終更新日2024-05-29
実験手法SOLUTION NMR
主引用文献Structural and dynamics insight of the recognition of Fbox protein by Skp1
To Be Published
4NL0
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BU of 4nl0 by Molmil
Structural and functional characterization of a novel Alpha Kinase in complex with ADP from Entamoeba histolytica
分子名称: ADENOSINE-5'-DIPHOSPHATE, Protein kinase, putative, ...
著者Tarique, K.F, Rehman, S.A.A, Bhattacharya, A, Gourinath, S, Mansuri, M.S.
登録日2013-11-13
公開日2014-11-19
最終更新日2024-11-06
実験手法X-RAY DIFFRACTION (2.41 Å)
主引用文献Structural and functional characterization of a novel Alpha Kinase in complex with ADP from Entamoeba histolytica
To be Published
6U6X
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BU of 6u6x by Molmil
Human SAMHD1 bound to deoxyribo(C*G*C*C*T)-oligonucleotide
分子名称: DNA SC-GS-SC-SC-DT, Deoxynucleoside triphosphate triphosphohydrolase SAMHD1, ZINC ION
著者Taylor, A.B, Bhattacharya, A, Wang, Z, Ivanov, D.N.
登録日2019-08-30
公開日2020-09-02
最終更新日2024-10-09
実験手法X-RAY DIFFRACTION (2.58 Å)
主引用文献Nucleic acid binding by SAMHD1 contributes to the antiretroviral activity and is enhanced by the GpsN modification.
Nat Commun, 12, 2021
6U6Y
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BU of 6u6y by Molmil
Human SAMHD1 bound to ribo(CGCCU)-oligonucleotide
分子名称: 2'-DEOXYADENOSINE 5'-TRIPHOSPHATE, Deoxynucleoside triphosphate triphosphohydrolase SAMHD1, RNA CGCCU, ...
著者Taylor, A.B, Bhattacharya, A, Wang, Z, Ivanov, D.N.
登録日2019-08-30
公開日2020-09-02
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.47 Å)
主引用文献Nucleic acid binding by SAMHD1 contributes to the antiretroviral activity and is enhanced by the GpsN modification.
Nat Commun, 12, 2021
1JFK
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BU of 1jfk by Molmil
MINIMUM ENERGY REPRESENTATIVE STRUCTURE OF A CALCIUM BOUND EF-HAND PROTEIN FROM ENTAMOEBA HISTOLYTICA
分子名称: CALCIUM ION, CALCIUM-BINDING PROTEIN
著者Atreya, H.S, Sahu, S.C, Bhattacharya, A, Chary, K.V.R, Govil, G.
登録日2001-06-21
公開日2001-12-19
最終更新日2024-05-29
実験手法SOLUTION NMR
主引用文献NMR derived solution structure of an EF-hand calcium-binding protein from Entamoeba Histolytica.
Biochemistry, 40, 2001
1JFJ
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BU of 1jfj by Molmil
NMR SOLUTION STRUCTURE OF AN EF-HAND CALCIUM BINDING PROTEIN FROM ENTAMOEBA HISTOLYTICA
分子名称: CALCIUM-BINDING PROTEIN
著者Atreya, H.S, Sahu, S.C, Bhattacharya, A, Chary, K.V.R, Govil, G.
登録日2001-06-20
公開日2001-12-19
最終更新日2024-05-29
実験手法SOLUTION NMR
主引用文献NMR derived solution structure of an EF-hand calcium-binding protein from Entamoeba Histolytica.
Biochemistry, 40, 2001
2M7K
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BU of 2m7k by Molmil
NMR solution structure of N-terminal domain of (Y81F)-EhCaBP1
分子名称: Calcium-binding protein
著者Chary, K.V, Rout, A.K, Patel, S, Bhattacharya, A.
登録日2013-04-25
公開日2013-07-10
最終更新日2024-05-01
実験手法SOLUTION NMR
主引用文献Functional Manipulation of a Calcium-binding Protein from Entamoeba histolytica Guided by Paramagnetic NMR.
J.Biol.Chem., 288, 2013
2LC5
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BU of 2lc5 by Molmil
Calmodulin-like Protein from Entamoeba histolytica: Solution Structure and Calcium-Binding Properties of a Partially Folded Protein
分子名称: CALCIUM ION, Calmodulin, putative
著者Rout, A.K, Padhan, N, Barnwal, R.P, Bhattacharya, A, Chary, K.V.
登録日2011-04-23
公開日2011-06-08
最終更新日2024-05-01
実験手法SOLUTION NMR
主引用文献Calmodulin like protein from Entamoeba histolytica: solution structure and calcium binding properties of a partially folded protein.
Biochemistry, 50, 2010
2M7M
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BU of 2m7m by Molmil
N-terminal domain of EhCaBP1 structure
分子名称: CALCIUM ION, Calcium-binding protein
著者Chary, K.V, Rout, A.K, Patel, S, Bhattacharya, A.
登録日2013-04-26
公開日2013-06-19
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Functional Manipulation of a Calcium-binding Protein from Entamoeba histolytica Guided by Paramagnetic NMR.
J.Biol.Chem., 288, 2013
2M7N
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BU of 2m7n by Molmil
C-terminal structure of (Y81F)-EhCaBP1
分子名称: CALCIUM ION, Calcium-binding protein
著者Chary, K.V, Rout, A.K, Patel, S, Bhattacharya, A.
登録日2013-04-26
公開日2013-06-19
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Functional Manipulation of a Calcium-binding Protein from Entamoeba histolytica Guided by Paramagnetic NMR.
J.Biol.Chem., 288, 2013
4QNB
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BU of 4qnb by Molmil
Disulfide stabilized HIV-1 CA hexamer in complex with PHENYL-L-PHENYLALANINAMIDE inhibitor
分子名称: CAPSID PROTEIN P24, N-METHYL-NALPHA-[(2-METHYL-1H-INDOL-3-YL)ACETYL]-N-PHENYL-L-PHENYLALANINAMIDE
著者Pornillos, O.
登録日2014-06-17
公開日2014-12-31
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (1.996 Å)
主引用文献Structural basis of HIV-1 capsid recognition by PF74 and CPSF6.
Proc.Natl.Acad.Sci.USA, 111, 2014
4WYM
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BU of 4wym by Molmil
Structural basis of HIV-1 capsid recognition by CPSF6
分子名称: Capsid protein p24, ISOFORM 2 OF CLEAVAGE AND POLYADENYLATION SPECIFICITY FACTOR SUBUNIT 6
著者Battacharya, A, Taylor, A.B, Hart, P.J, Ivanov, D.N.
登録日2014-11-17
公開日2014-12-17
最終更新日2024-11-20
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Structural basis of HIV-1 capsid recognition by PF74 and CPSF6.
Proc.Natl.Acad.Sci.USA, 111, 2014
6YVA
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BU of 6yva by Molmil
PLpro-C111S with mISG15
分子名称: Replicase polyprotein 1a, Ubiquitin-like protein ISG15, ZINC ION
著者Shin, D, Dikic, I.
登録日2020-04-28
公開日2020-05-13
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (3.18 Å)
主引用文献Papain-like protease regulates SARS-CoV-2 viral spread and innate immunity.
Nature, 587, 2020
1L7B
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BU of 1l7b by Molmil
Solution NMR Structure of BRCT Domain of T. Thermophilus: Northeast Structural Genomics Consortium Target WR64TT
分子名称: DNA LIGASE
著者Sahota, G, Dixon, B.L, Huang, Y.P, Aramini, J, Monleon, D, Bhattacharya, D, Swapna, G.V.T, Yin, C, Xiao, R, Anderson, S, Tejero, R, Montelione, G.T, Northeast Structural Genomics Consortium (NESG)
登録日2002-03-14
公開日2003-09-16
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献Solution NMR Structure of the Brct Domain from Thermus Thermophilus DNA Ligase
To be Published
9MIE
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BU of 9mie by Molmil
Human NLRP3 complex with compound 2 in the closed hexamer
分子名称: (2P)-2-(4-{[(3R)-1-methylpiperidin-3-yl]amino}-6,7-dihydro-5H-cyclopenta[d]pyridazin-1-yl)-5-(trifluoromethyl)phenol, ADENOSINE-5'-TRIPHOSPHATE, NACHT, ...
著者Mammoliti, O, Carbajo, R.J, Perez-Benito, L, Yu, X.
登録日2024-12-12
公開日2025-02-26
最終更新日2025-03-12
実験手法ELECTRON MICROSCOPY (3.93 Å)
主引用文献Discovery of Potent and Brain-Penetrant Bicyclic NLRP3 Inhibitors with Peripheral and Central In Vivo Activity.
J.Med.Chem., 68, 2025
9FGM
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BU of 9fgm by Molmil
Cryo-EM structure of Legionella effector SdeC (3D flexible refinement)
分子名称: SdeC
著者Weng, T.-H, Misra, M, Chen, W, Safarian, S, Kudryashev, M, Dikic, I.
登録日2024-05-24
公開日2025-06-04
最終更新日2025-06-18
実験手法ELECTRON MICROSCOPY (4 Å)
主引用文献BAR-like C-terminal domain of Legionella SidE family is crucial for its membrane localization and secretion
To Be Published
9FGJ
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BU of 9fgj by Molmil
Cryo-EM structure of Legionella effector SdeC (PDE-mART domain)
分子名称: SdeC
著者Weng, T.-H, Misra, M, Chen, W, Safarian, S, Kudryashev, M, Dikic, I.
登録日2024-05-24
公開日2025-06-04
実験手法ELECTRON MICROSCOPY (3.8 Å)
主引用文献BAR-like C-terminal domain of Legionella SidE family is crucial for its membrane localization and secretion
To Be Published
4LKA
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BU of 4lka by Molmil
Crystal Structure of MOZ double PHD finger histone H3K9ac complex
分子名称: Histone H3.1, Histone acetyltransferase KAT6A, ZINC ION
著者Dreveny, I, Deeves, S.E, Yue, B, Heery, D.M.
登録日2013-07-07
公開日2013-10-16
最終更新日2024-11-27
実験手法X-RAY DIFFRACTION (1.61 Å)
主引用文献The double PHD finger domain of MOZ/MYST3 induces alpha-helical structure of the histone H3 tail to facilitate acetylation and methylation sampling and modification.
Nucleic Acids Res., 42, 2014
4LLB
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BU of 4llb by Molmil
Crystal Structure of MOZ double PHD finger histone H3K14ac complex
分子名称: Histone H3.1, Histone acetyltransferase KAT6A, ZINC ION
著者Dreveny, I, Deeves, S.E, Yue, B, Heery, D.M.
登録日2013-07-09
公開日2013-10-16
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献The double PHD finger domain of MOZ/MYST3 induces alpha-helical structure of the histone H3 tail to facilitate acetylation and methylation sampling and modification.
Nucleic Acids Res., 42, 2014
4LJN
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BU of 4ljn by Molmil
Crystal Structure of MOZ double PHD finger
分子名称: Histone acetyltransferase KAT6A, ZINC ION
著者Dreveny, I, Deeves, S.E, Yue, B, Heery, D.M.
登録日2013-07-05
公開日2013-10-16
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献The double PHD finger domain of MOZ/MYST3 induces alpha-helical structure of the histone H3 tail to facilitate acetylation and methylation sampling and modification.
Nucleic Acids Res., 42, 2014

 

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