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8H9B
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Crystal structure of chemically modified E. coli ThrS catalytic domain 3
分子名称: N-(2,3-dihydroxybenzoyl)-4-(4-nitrophenyl)-L-threonine, Threonine--tRNA ligase, ZINC ION
著者Qiao, H, Xia, M, Wang, J, Fang, P.
登録日2022-10-25
公開日2023-02-08
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2.23 Å)
主引用文献Tyrosine-targeted covalent inhibition of a tRNA synthetase aided by zinc ion.
Commun Biol, 6, 2023
8CDB
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BU of 8cdb by Molmil
Proulilysin E229A structure
分子名称: CALCIUM ION, Ulilysin, ZINC ION
著者Rodriguez-Banqueri, A, Eckhard, U, Gomis-Ruth, F.X.
登録日2023-01-30
公開日2023-03-22
最終更新日2023-03-29
実験手法X-RAY DIFFRACTION (4.5 Å)
主引用文献Structural insights into latency of the metallopeptidase ulilysin (lysargiNase) and its unexpected inhibition by a sulfonyl-fluoride inhibitor of serine peptidases.
Dalton Trans, 52, 2023
6XYW
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BU of 6xyw by Molmil
Structure of the plant mitochondrial ribosome
分子名称: 28S ribosomal S34 protein, 3-hydroxyisobutyryl-CoA hydrolase-like protein 2, mitochondrial, ...
著者Soufari, H, Waltz, F, Bochler, A, Giege, P, Hashem, Y.
登録日2020-01-31
公開日2020-04-15
最終更新日2020-04-29
実験手法ELECTRON MICROSCOPY (3.86 Å)
主引用文献Cryo-EM structure of the RNA-rich plant mitochondrial ribosome.
Nat.Plants, 6, 2020
1INH
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BU of 1inh by Molmil
INFLUENZA A SUBTYPE N2 NEURAMINIDASE COMPLEXED WITH AROMATIC BANA111 INHIBITOR
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 4-(ACETYLAMINO)-3-[(AMINOACETYL)AMINO]BENZOIC ACID, CALCIUM ION, ...
著者Jedrzejas, M.J, Luo, M.
登録日1995-07-07
公開日1996-08-17
最終更新日2020-07-29
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Structure-based inhibitors of influenza virus sialidase. A benzoic acid lead with novel interaction.
J.Med.Chem., 38, 1995
6ER6
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BU of 6er6 by Molmil
Crystal structure of a computationally designed colicin endonuclease and immunity pair colEdes7/Imdes7
分子名称: Endonuclease colEdes7, immunity Imdes7
著者Netzer, R, Listov, D, Dym, O, Albeck, S, Knop, O, Fleishman, S.J.
登録日2017-10-17
公開日2019-01-30
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Ultrahigh specificity in a network of computationally designed protein-interaction pairs.
Nat Commun, 9, 2018
8C9K
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BU of 8c9k by Molmil
Structure of Mpox virus poxin
分子名称: MPXVgp165
著者Duchoslav, V, Boura, E.
登録日2023-01-23
公開日2023-05-31
最終更新日2024-06-19
実験手法X-RAY DIFFRACTION (1.72 Å)
主引用文献Structure of Mpox virus poxin
To Be Published
8H9A
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BU of 8h9a by Molmil
Crystal structure of chemically modified E. coli ThrS catalytic domain 2
分子名称: N-(2,3-dihydroxybenzoyl)-4-(4-nitrophenyl)-L-threonine, Threonine--tRNA ligase, ZINC ION
著者Qiao, H, Xia, M, Wang, J, Fang, P.
登録日2022-10-25
公開日2023-02-08
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Tyrosine-targeted covalent inhibition of a tRNA synthetase aided by zinc ion.
Commun Biol, 6, 2023
1BHM
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BU of 1bhm by Molmil
RESTRICTION ENDONUCLEASE BAMHI COMPLEX WITH DNA
分子名称: DNA (5'-D(*TP*AP*TP*GP*GP*AP*TP*CP*CP*AP*TP*A)-3'), PROTEIN (BAMHI (E.C.3.1.21.4))
著者Aggarwal, A.K, Newman, M.
登録日1995-07-12
公開日1995-07-12
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Structure of Bam HI endonuclease bound to DNA: partial folding and unfolding on DNA binding.
Science, 269, 1995
1BDW
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BU of 1bdw by Molmil
GRAMICIDIN D FROM BACILLUS BREVIS (ACTIVE FORM)
分子名称: ACETIC ACID, GRAMICIDIN A
著者Burkhart, B.M, Pangborn, W.A, Duax, W.L.
登録日1998-05-11
公開日1998-10-14
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献The Conducting Form of Gramicidin a is a Right-Handed Double-Stranded Double Helix.
Proc.Natl.Acad.Sci.USA, 95, 1998
8C4J
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BU of 8c4j by Molmil
CdaA-compound 4 complex
分子名称: 5-methylpyrimidin-4-amine, CHLORIDE ION, Diadenylate cyclase
著者Neumann, P, Ficner, R.
登録日2023-01-04
公開日2023-06-07
最終更新日2024-06-19
実験手法X-RAY DIFFRACTION (1.83 Å)
主引用文献Computer-aided design of a cyclic di-AMP synthesizing enzyme CdaA inhibitor.
Microlife, 4, 2023
8C4N
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BU of 8c4n by Molmil
CdaA-AMP complex
分子名称: ADENOSINE MONOPHOSPHATE, CHLORIDE ION, Diadenylate cyclase, ...
著者Neumann, P, Ficner, R.
登録日2023-01-04
公開日2023-06-07
最終更新日2024-06-19
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Computer-aided design of a cyclic di-AMP synthesizing enzyme CdaA inhibitor.
Microlife, 4, 2023
8C4Q
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BU of 8c4q by Molmil
CdaA-Apo
分子名称: CHLORIDE ION, Diadenylate cyclase
著者Neumann, P, Ficner, R.
登録日2023-01-04
公開日2023-06-07
最終更新日2024-06-19
実験手法X-RAY DIFFRACTION (1.45 Å)
主引用文献Computer-aided design of a cyclic di-AMP synthesizing enzyme CdaA inhibitor.
Microlife, 4, 2023
8C4O
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BU of 8c4o by Molmil
CdaA-ATP complex
分子名称: ADENOSINE-5'-TRIPHOSPHATE, CHLORIDE ION, Diadenylate cyclase, ...
著者Neumann, P, Ficner, R.
登録日2023-01-04
公開日2023-06-07
最終更新日2024-06-19
実験手法X-RAY DIFFRACTION (1.97 Å)
主引用文献Computer-aided design of a cyclic di-AMP synthesizing enzyme CdaA inhibitor.
Microlife, 4, 2023
8C4R
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BU of 8c4r by Molmil
CdaA-adenine complex
分子名称: ADENINE, CHLORIDE ION, Diadenylate cyclase
著者Neumann, P, Ficner, R.
登録日2023-01-04
公開日2023-06-07
最終更新日2024-06-19
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献Computer-aided design of a cyclic di-AMP synthesizing enzyme CdaA inhibitor.
Microlife, 4, 2023
2ZHB
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BU of 2zhb by Molmil
Complex structure of AFCCA with tRNAminiDUC
分子名称: CCA-adding enzyme, SULFATE ION, tRNA (34-MER)
著者Toh, Y, Tomita, K.
登録日2008-02-01
公開日2008-08-05
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (3.05 Å)
主引用文献Molecular basis for maintenance of fidelity during the CCA-adding reaction by a CCA-adding enzyme
Embo J., 27, 2008
4Q7E
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BU of 4q7e by Molmil
Non-phosphorylated HemR Receiver Domain from Leptospira biflexa
分子名称: GLYCEROL, Response regulator of a two component regulatory system, SULFATE ION
著者Morero, N.R, Buschiazzo, A.
登録日2014-04-24
公開日2014-05-14
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.441 Å)
主引用文献HemR is an OmpR/PhoB-like response regulator from Leptospira, which simultaneously effects transcriptional activation and repression of key haem metabolism genes.
Mol.Microbiol., 94, 2014
6XRE
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BU of 6xre by Molmil
Structure of the p53/RNA polymerase II assembly
分子名称: Cellular tumor antigen p53, DNA-directed RNA polymerase II subunit RPB1, DNA-directed RNA polymerase II subunit RPB11-a, ...
著者Liou, S.-H, Singh, S, Singer, R.H, Coleman, R.A, Liu, W.
登録日2020-07-12
公開日2021-03-24
最終更新日2024-03-06
実験手法ELECTRON MICROSCOPY (4.6 Å)
主引用文献Structure of the p53/RNA polymerase II assembly.
Commun Biol, 4, 2021
1B9T
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BU of 1b9t by Molmil
NOVEL AROMATIC INHIBITORS OF INFLUENZA VIRUS NEURAMINIDASE MAKE SELECTIVE INTERACTIONS WITH CONSERVED RESIDUES AND WATER MOLECULES IN THE ACTIVE SITE
分子名称: 1-(4-CARBOXY-2-GUANIDINOPENTYL)-5,5'-DI(HYDROXYMETHYL)PYRROLIDIN-2-ONE, 2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, ...
著者Finley, J.B, Atigadda, V.R, Duarte, F, Zhao, J.J, Brouillette, W.J, Air, G.M, Luo, M.
登録日1999-02-15
公開日1999-02-27
最終更新日2023-08-09
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Novel aromatic inhibitors of influenza virus neuraminidase make selective interactions with conserved residues and water molecules in the active site.
J.Mol.Biol., 293, 1999
8CBR
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BU of 8cbr by Molmil
HIV-1 Integrase Catalytic Core Domain and C-Terminal Domain in Complex with Allosteric Integrase Inhibitor BDM-2
分子名称: (2S)-2-[3-cyclopropyl-2-(3,4-dihydro-2H-chromen-6-yl)-6-methyl-phenyl]-2-[(2-methylpropan-2-yl)oxy]ethanoic acid, 1,2-ETHANEDIOL, CHLORIDE ION, ...
著者Singer, M.R, Pye, V.E, Yu, Z, Cherepanov, P.
登録日2023-01-25
公開日2023-06-07
最終更新日2024-06-19
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Biological and Structural Analyses of New Potent Allosteric Inhibitors of HIV-1 Integrase.
Antimicrob.Agents Chemother., 67, 2023
8CBU
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BU of 8cbu by Molmil
HIV-1 Integrase Catalytic Core Domain and C-Terminal Domain in Complex with Allosteric Integrase Inhibitor MUT884
分子名称: (2S)-2-[3-cyclopropyl-6-methyl-2-(5-methyl-3,4-dihydro-2H-chromen-6-yl)phenyl]-2-cyclopropyloxy-ethanoic acid, 1,2-ETHANEDIOL, CHLORIDE ION, ...
著者Singer, M.R, Pye, V.E, Yu, Z, Cherepanov, P.
登録日2023-01-25
公開日2023-06-07
最終更新日2024-06-19
実験手法X-RAY DIFFRACTION (2.44 Å)
主引用文献Biological and Structural Analyses of New Potent Allosteric Inhibitors of HIV-1 Integrase.
Antimicrob.Agents Chemother., 67, 2023
8CBV
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BU of 8cbv by Molmil
HIV-1 Integrase Catalytic Core Domain and C-Terminal Domain in Complex with Allosteric Integrase Inhibitor MUT916
分子名称: (2~{S})-2-[3-cyclopropyl-2-(8-fluoranyl-5-methyl-3,4-dihydro-2~{H}-chromen-6-yl)-6-methyl-phenyl]-2-cyclopropyloxy-ethanoic acid, 1,2-ETHANEDIOL, CHLORIDE ION, ...
著者Singer, M.R, Pye, V.E, Yu, Z, Cherepanov, P.
登録日2023-01-25
公開日2023-06-07
最終更新日2024-06-19
実験手法X-RAY DIFFRACTION (1.82 Å)
主引用文献Biological and Structural Analyses of New Potent Allosteric Inhibitors of HIV-1 Integrase.
Antimicrob.Agents Chemother., 67, 2023
1X1Y
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BU of 1x1y by Molmil
Water-mediate interaction at aprotein-protein interface
分子名称: Barstar, Ribonuclease
著者Ikura, T, Urakubo, Y, Ito, N.
登録日2005-04-15
公開日2005-04-26
最終更新日2024-05-29
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Water-mediated interaction at a protein-protein interface
Chem.Phys., 307, 2004
8C4M
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BU of 8c4m by Molmil
CdaA-Adenosine complex
分子名称: ADENOSINE, CHLORIDE ION, Diadenylate cyclase
著者Neumann, P, Ficner, R.
登録日2023-01-04
公開日2023-06-07
最終更新日2024-06-19
実験手法X-RAY DIFFRACTION (1.51 Å)
主引用文献Computer-aided design of a cyclic di-AMP synthesizing enzyme CdaA inhibitor.
Microlife, 4, 2023
1BGS
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BU of 1bgs by Molmil
RECOGNITION BETWEEN A BACTERIAL RIBONUCLEASE, BARNASE, AND ITS NATURAL INHIBITOR, BARSTAR
分子名称: BARNASE, BARSTAR
著者Guillet, V, Lapthorn, A, Mauguen, Y.
登録日1993-11-02
公開日1994-04-30
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Recognition between a bacterial ribonuclease, barnase, and its natural inhibitor, barstar.
Structure, 1, 1993
8CBT
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BU of 8cbt by Molmil
HIV-1 Integrase Catalytic Core Domain and C-Terminal Domain in Complex with Allosteric Integrase Inhibitor MUT872
分子名称: (2~{S})-2-[3-cyclopropyl-2-(3,4-dihydro-2~{H}-chromen-6-yl)-6-methyl-phenyl]-2-cyclopropyloxy-ethanoic acid, 1,2-ETHANEDIOL, CHLORIDE ION, ...
著者Singer, M.R, Pye, V.E, Yu, Z, Cherepanov, P.
登録日2023-01-25
公開日2023-06-07
最終更新日2024-06-19
実験手法X-RAY DIFFRACTION (2.14 Å)
主引用文献Biological and Structural Analyses of New Potent Allosteric Inhibitors of HIV-1 Integrase.
Antimicrob.Agents Chemother., 67, 2023

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