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PDB: 51630 件

5MRP
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Arabidopsis thaliana IspD Glu258Ala mutant in complex with Azolopyrimidine (2)
分子名称: 2-C-methyl-D-erythritol 4-phosphate cytidylyltransferase, chloroplastic, 5-chloro-7-hydroxy-6-(phenylmethyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile, ...
著者Schwab, A, Illarionov, B, Frank, A, Kunfermann, A, Seet, M, Bacher, A, Witschel, M, Fischer, M, Groll, M, Diederich, F.
登録日2016-12-23
公開日2017-07-19
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Mechanism of Allosteric Inhibition of the Enzyme IspD by Three Different Classes of Ligands.
ACS Chem. Biol., 12, 2017
8DEE
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Asymmetric Unit of Western Equine Encephalitis Virus
分子名称: Capsid protein, Spike glycoprotein E1, Spike glycoprotein E2
著者Pletnev, S, Verardi, R, Roedeger, M, Kwong, P.
登録日2022-06-20
公開日2023-07-05
最終更新日2024-01-17
実験手法ELECTRON MICROSCOPY (3.4 Å)
主引用文献Vaccine elicitation and structural basis for antibody protection against alphaviruses.
Cell, 186, 2023
8DEF
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Cryo-EM Structure of Western Equine Encephalitis Virus VLP in complex with SKW24 fab
分子名称: SKW24 Fab heavy chain, SKW24 Fab light chain, Spike glycoprotein E1, ...
著者Pletnev, S, Tsybovsky, Y, Verardi, R, Roedeger, M, Kwong, P.D.
登録日2022-06-20
公開日2023-07-05
最終更新日2024-01-17
実験手法ELECTRON MICROSCOPY (4.2 Å)
主引用文献Vaccine elicitation and structural basis for antibody protection against alphaviruses.
Cell, 186, 2023
5CM1
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X-ray structure of perdeuterated TTR mutant - T119M at 1.22A
分子名称: Transthyretin
著者Yee, A.W, Moulin, M, Mossou, E, Haertlein, M, Mitchell, E.P, Cooper, J.B, Forsyth, V.T.
登録日2015-07-16
公開日2016-07-27
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.22 Å)
主引用文献X-ray structure of perdeuterated TTR mutant - T119M at 1.22A
To Be Published
5CMA
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Anti-B7-H3 monoclonal antibody ch8H9 Fab fragment
分子名称: Antibody ch8H9 Fab heavy chain, Antibody ch8H9 Fab light chain
著者Ahmed, M, Goldgur, Y, Cheng, M, Cheung, N.K.
登録日2015-07-16
公開日2015-10-28
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Humanized Affinity-matured Monoclonal Antibody 8H9 Has Potent Antitumor Activity and Binds to FG Loop of Tumor Antigen B7-H3.
J.Biol.Chem., 290, 2015
6BBE
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Structure of N-glycosylated porcine surfactant protein-D
分子名称: 2-(2-{2-[2-(2-METHOXY-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHANOL, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-2)-alpha-D-mannopyranose-(1-3)-[2-acetamido-2-deoxy-beta-D-glucopyranose-(1-2)-alpha-D-mannopyranose-(1-6)]beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, ...
著者van Eijk, M, Rynkiewicz, M.J, Khatri, K, Leymarie, N, Zaia, J, White, M.R, Hartshorn, K.L, Cafarella, T.R, van Die, I, Hessing, M, Seaton, B.A, Haagsman, H.P.
登録日2017-10-18
公開日2018-05-23
最終更新日2021-03-24
実験手法X-RAY DIFFRACTION (1.898 Å)
主引用文献Lectin-mediated binding and sialoglycans of porcine surfactant protein D synergistically neutralize influenza A virus.
J. Biol. Chem., 293, 2018
1WN5
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Crystal Structure of Blasticidin S Deaminase (BSD) Complexed with Cacodylic Acid
分子名称: Blasticidin-S deaminase, CACODYLATE ION, ZINC ION
著者Kumasaka, T, Yamamoto, M, Furuichi, M, Nakasako, M, Kimura, M, Yamaguchi, I, Ueki, T.
登録日2004-07-27
公開日2005-10-25
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Crystal structures of blasticidin S deaminase (BSD): implications for dynamic properties of catalytic zinc
J.Biol.Chem., 282, 2007
6T0Q
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Pleurotus Ostreatus Lectin (POL), apo form
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Destefanis, L, Perduca, M, Bovi, M, Monaco, H.L, Capaldi, S.
登録日2019-10-03
公開日2020-02-19
最終更新日2022-12-07
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Structure and properties of the oyster mushroom (Pleurotus ostreatus) lectin.
Glycobiology, 30, 2020
6T1D
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Pleurotus Ostreatus Lectin (POL), compelx with melibiose
分子名称: CALCIUM ION, Lectin, alpha-D-galactopyranose-(1-6)-alpha-D-glucopyranose
著者Destefanis, L, Perduca, M, Bovi, M, Monaco, H.L, Capaldi, S.
登録日2019-10-04
公開日2020-02-19
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Structure and properties of the oyster mushroom (Pleurotus ostreatus) lectin.
Glycobiology, 30, 2020
7PVO
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Adenylosuccinate Synthetase from H. pylori in complex with IMP
分子名称: Adenylosuccinate synthetase, INOSINIC ACID, SULFATE ION
著者Narczyk, M, Bzowska, A, Maksymiuk, W.
登録日2021-10-05
公開日2022-11-16
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献The pursuit of new alternative ways to eradicate Helicobacter pylori continues: Detailed characterization of interactions in the adenylosuccinate synthetase active site.
Int.J.Biol.Macromol., 226, 2023
6V4J
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Structure of TrkH-TrkA in complex with ATP
分子名称: Potassium uptake protein TrkA, Trk system potassium uptake protein TrkH
著者Zhou, M, Zhang, H.
登録日2019-11-27
公開日2020-02-12
実験手法ELECTRON MICROSCOPY (2.97 Å)
主引用文献TrkA undergoes a tetramer-to-dimer conversion to open TrkH which enables changes in membrane potential.
Nat Commun, 11, 2020
6V4L
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Structure of TrkH-TrkA in complex with ATPgammaS
分子名称: PHOSPHOTHIOPHOSPHORIC ACID-ADENYLATE ESTER, Potassium uptake protein TrkA, Trk system potassium uptake protein TrkH
著者Zhou, M, Zhang, H.
登録日2019-11-27
公開日2020-02-12
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (3.8 Å)
主引用文献TrkA undergoes a tetramer-to-dimer conversion to open TrkH which enables changes in membrane potential.
Nat Commun, 11, 2020
2QIM
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BU of 2qim by Molmil
Crystal Structure of Pathogenesis-related Protein LlPR-10.2B from yellow lupine in complex with Cytokinin
分子名称: (2E)-2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol, CALCIUM ION, GLYCEROL, ...
著者Fernandes, H.C, Pasternak, O, Bujacz, G, Bujacz, A, Sikorski, M.M, Jaskolski, M.
登録日2007-07-05
公開日2008-04-29
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (1.35 Å)
主引用文献Lupinus luteus pathogenesis-related protein as a reservoir for cytokinin.
J.Mol.Biol., 378, 2008
5JPX
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BU of 5jpx by Molmil
Solution structure of the TRIM21 B-box2 (B2)
分子名称: E3 ubiquitin-protein ligase TRIM21, ZINC ION
著者Wallenhammar, A, Anandapadamanaban, M, Sunnerhagen, M.
登録日2016-05-04
公開日2017-08-09
最終更新日2024-06-19
実験手法SOLUTION NMR
主引用文献Solution NMR structure of the TRIM21 B-box2 and identification of residues involved in its interaction with the RING domain.
PLoS ONE, 12, 2017
5C0L
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Fragment-Based Drug Discovery Targeting Inhibitor of Apoptosis Proteins: Compound 2
分子名称: 4-(4-bromo-1H-pyrazol-1-yl)piperidinium, E3 ubiquitin-protein ligase XIAP, ZINC ION
著者Chessari, G, Buck, I.M, Day, J.E.H, Day, P.J, Iqbal, A, Johnson, C.N, Lewis, E.J, Martins, V, Miller, D, Reader, M, Rees, D.C, Rich, S.J, Tamanini, E, Vitorino, M, Ward, G.A, Williams, P.A, Williams, G, Wilsher, N.E, Woolford, A.J.-A.
登録日2015-06-12
公開日2015-08-12
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Fragment-Based Drug Discovery Targeting Inhibitor of Apoptosis Proteins: Discovery of a Non-Alanine Lead Series with Dual Activity Against cIAP1 and XIAP.
J.Med.Chem., 58, 2015
6F9N
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CRYSTAL STRUCTURE OF THE HUMAN CPSF160-WDR33 COMPLEX
分子名称: Cleavage and polyadenylation specificity factor subunit 1, pre-mRNA 3' end processing protein WDR33
著者Clerici, M, Jinek, M.
登録日2017-12-14
公開日2018-01-03
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Structural insights into the assembly and polyA signal recognition mechanism of the human CPSF complex.
Elife, 6, 2017
6FCJ
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Estimation of Protein-Ligand Unbinding Kinetics Using Non-Equilibrium Targeted Molecular Dynamics Simulations
分子名称: 4-[2-(2-chlorophenyl)pyrazol-3-yl]benzene-1,3-diol, Heat shock protein HSP 90-alpha
著者Musil, D, Lehmann, M, Eggenweiler, H.-M.
登録日2017-12-20
公開日2019-01-30
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.49 Å)
主引用文献Estimation of Protein-Ligand Unbinding Kinetics Using Non-Equilibrium Targeted Molecular Dynamics Simulations
Arxiv, 2019
7T0H
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Crystal structure of S25-39 Fab Unliganded 2
分子名称: BROMIDE ION, S25-39 Fab heavy chain, S25-39 Fab light chain
著者Legg, M.S.G, Blackler, R.J, Evans, S.V.
登録日2021-11-29
公開日2022-04-20
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.3 Å)
主引用文献Antigen binding by conformational selection in near-germline antibodies.
J.Biol.Chem., 298, 2022
7AI8
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Structure of Ribonucleotide reductase R2 from Escherichia coli collected by still serial crystallography on a COC membrane at a synchrotron source
分子名称: FE (III) ION, Ribonucleoside-diphosphate reductase 1 subunit beta
著者Aurelius, O, John, J, Martiel, I, Padeste, C, Karpik, A, Huang, C.Y, Hogbom, M, Wang, M, Marsh, M.
登録日2020-09-26
公開日2021-09-01
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Versatile microporous polymer-based supports for serial macromolecular crystallography.
Acta Crystallogr D Struct Biol, 77, 2021
7AI9
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Structure of Ribonucleotide reductase R2 from Escherichia coli collected by rotation serial crystallography on a COC membrane at a synchrotron source
分子名称: FE (III) ION, Ribonucleoside-diphosphate reductase 1 subunit beta
著者Aurelius, O, John, J, Martiel, I, Padeste, C, Karpik, A, Huang, C.Y, Hogbom, M, Wang, M, Marsh, M.
登録日2020-09-26
公開日2021-09-01
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Versatile microporous polymer-based supports for serial macromolecular crystallography.
Acta Crystallogr D Struct Biol, 77, 2021
5GJG
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Crystal structure of human TAK1/TAB1 fusion protein in complex with ligand 4
分子名称: N-(2-isopropoxy-4-(4-methylpiperazine-1-carbonyl)phenyl)-2-(3-(phenylcarbamoyl)phenyl)thiazole-4-carboxamide, TAK1 kinase - TAB1 chimera fusion protein
著者Irie, M, Nakamura, M, Fukami, T.A, Matsuura, T, Morishima, K.
登録日2016-06-29
公開日2016-11-16
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (2.61 Å)
主引用文献Development of a Method for Converting a TAK1 Type I Inhibitor into a Type II or c-Helix-Out Inhibitor by Structure-Based Drug Design (SBDD)
Chem.Pharm.Bull., 64, 2016
7T0I
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Crystal structure of S25-39 Fab Unliganded 3
分子名称: S25-39 Fab heavy chain, S25-39 Fab light chain
著者Legg, M.S.G, Blackler, R.J, Evans, S.V.
登録日2021-11-29
公開日2022-04-20
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Antigen binding by conformational selection in near-germline antibodies.
J.Biol.Chem., 298, 2022
5C3K
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Fragment-Based Drug Discovery Targeting Inhibitor of Apoptosis Proteins: Compound 4
分子名称: (2S)-1-[(6-aminopyridin-2-yl)amino]-1-oxopropan-2-aminium, E3 ubiquitin-protein ligase XIAP, ZINC ION
著者Chessari, G, Buck, I.M, Day, J.E.H, Day, P.J, Iqbal, A, Johnson, C.N, Lewis, E.J, Martins, V, Miller, D, Reader, M, Rees, D.C, Rich, S.J, Tamanini, E, Vitorino, M, Ward, G.A, Williams, P.A, Williams, G, Wilsher, N.E, Woolford, A.J.-A.
登録日2015-06-17
公開日2015-08-12
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.02 Å)
主引用文献Fragment-Based Drug Discovery Targeting Inhibitor of Apoptosis Proteins: Discovery of a Non-Alanine Lead Series with Dual Activity Against cIAP1 and XIAP.
J.Med.Chem., 58, 2015
6VHD
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FphF, Staphylococcus aureus fluorophosphonate-binding serine hydrolases F, KT129 bound
分子名称: (2~{R})-2-phenylpiperidine-1-carbaldehyde, Esterase family protein
著者Fellner, M, Mace, P.D.
登録日2020-01-09
公開日2020-09-16
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.98 Å)
主引用文献Structural Basis for the Inhibitor and Substrate Specificity of the Unique Fph Serine Hydrolases of Staphylococcus aureus .
Acs Infect Dis., 6, 2020
7T0G
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Crystal structure of S25-39 Fab Unliganded 1
分子名称: 2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, S25-39 Fab heavy chain, S25-39 Fab light chain
著者Legg, M.S.G, Blackler, R.J, Evans, S.V.
登録日2021-11-29
公開日2022-04-20
最終更新日2023-10-18
実験手法X-RAY DIFFRACTION (1.53 Å)
主引用文献Antigen binding by conformational selection in near-germline antibodies.
J.Biol.Chem., 298, 2022

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