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5R91
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PanDDA analysis group deposition Form1 MAP kinase p38-alpha -- Fragment KCL057 in complex with MAP kinase p38-alpha
分子名称: 2-[4-(2-aminophenyl)piperazin-1-yl]ethanol, ACETATE ION, CHLORIDE ION, ...
著者De Nicola, G.F, Nichols, C.E.
登録日2020-03-04
公開日2020-07-22
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.731 Å)
主引用文献Mining the PDB for Tractable Cases Where X-ray Crystallography Combined with Fragment Screens Can Be Used to Systematically Design Protein-Protein Inhibitors: Two Test Cases Illustrated by IL1 beta-IL1R and p38 alpha-TAB1 Complexes.
J.Med.Chem., 63, 2020
2M17
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ubiquitin-like domain-containing C-terminal domain phosphatase (UBLCP1)
分子名称: Ubiquitin-like domain-containing CTD phosphatase 1
著者Lee, W, Yun, J.
登録日2012-11-19
公開日2013-06-05
最終更新日2023-06-14
実験手法SOLUTION NMR
主引用文献Solution Structure and Rpn1 Interaction of the UBL Domain of Human RNA Polymerase II C-Terminal Domain Phosphatase.
Plos One, 8, 2013
4G29
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Structure of the Catalytic Domain of the Salmonella Virulence Factor SseI
分子名称: Secreted effector protein sseI
著者Stebbins, C.E, Bhaskaran, S.S.
登録日2012-07-11
公開日2012-11-28
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Structure of the catalytic domain of the Salmonella virulence factor SseI.
Acta Crystallogr.,Sect.D, 68, 2012
4AL2
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peptide deformylase (Ni-form) with hydrosulfide
分子名称: HYDROSULFURIC ACID, NICKEL (II) ION, PEPTIDE DEFORMYLASE
著者Palm, G.J, Hinrichs, W.
登録日2012-02-29
公開日2012-04-04
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献A Fret Enzyme-Based Probe for Monitoring Hydrogen Sulfide.
Inorg.Chem., 51, 2012
6DXP
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BU of 6dxp by Molmil
The crystal structure of an FMN-dependent NADH-azoreductase from Klebsiella pneumoniae
分子名称: FLAVIN MONONUCLEOTIDE, FMN-dependent NADH-azoreductase
著者Arcinas, A.J, Ghosh, A, Chamala, S, Bonanno, J.B, Kelly, L, Almo, S.C.
登録日2018-06-29
公開日2018-07-25
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.478 Å)
主引用文献The crystal structure of an FMN-dependent NADH-azoreductase from Klebsiella pneumoniae
To Be Published
4CHE
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BU of 4che by Molmil
Crystal structure of the putative cap-binding domain of the PB2 subunit of Thogoto virus polymerase
分子名称: POLYMERASE BASIC PROTEIN 2
著者Guilligay, D, Kadlec, J, Crepin, T, Lunardi, T, Bouvier, D, Kochs, G, Ruigrok, R.W.H, Cusack, S.
登録日2013-12-01
公開日2014-02-05
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Comparative Structural and Functional Analysis of Orthomyxovirus Polymerase CAP-Snatching Domains.
Plos One, 9, 2014
4DX7
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Transport of drugs by the multidrug transporter AcrB involves an access and a deep binding pocket that are separated by a switch-loop
分子名称: Acriflavine resistance protein B, DARPIN, DECANE, ...
著者Eicher, T, Cha, H, Seeger, M.A, Brandstaetter, L, El-Delik, J, Bohnert, J.A, Kern, W.V, Verrey, F, Gruetter, M.G, Diederichs, K, Pos, K.M.
登録日2012-02-27
公開日2012-05-02
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.253 Å)
主引用文献Transport of drugs by the multidrug transporter AcrB involves an access and a deep binding pocket that are separated by a switch-loop.
Proc.Natl.Acad.Sci.USA, 109, 2012
3G9W
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Crystal Structure of Talin2 F2-F3 in Complex with the Integrin Beta1D Cytoplasmic Tail
分子名称: DI(HYDROXYETHYL)ETHER, GLYCEROL, Integrin beta-1D, ...
著者Anthis, N.J, Wegener, K.L, Ye, F, Kim, C, Lowe, E.D, Vakonakis, I, Bate, N, Critchley, D.R, Ginsberg, M.H, Campbell, I.D.
登録日2009-02-15
公開日2009-10-20
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.165 Å)
主引用文献The structure of an integrin/talin complex reveals the basis of inside-out signal transduction
Embo J., 28, 2009
7A24
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Assembly intermediate of the plant mitochondrial complex I
分子名称: (1S)-2-{[(2-AMINOETHOXY)(HYDROXY)PHOSPHORYL]OXY}-1-[(PALMITOYLOXY)METHYL]ETHYL STEARATE, 13kDa, 15kDa, ...
著者Soufari, H, Waltz, F, Hashem, Y.
登録日2020-08-16
公開日2020-10-28
実験手法ELECTRON MICROSCOPY (3.8 Å)
主引用文献Specific features and assembly of the plant mitochondrial complex I revealed by cryo-EM.
Nat Commun, 11, 2020
2HPI
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BU of 2hpi by Molmil
Eubacterial and Eukaryotic Replicative DNA Polymerases are not Homologous: X-ray Structure of DNA Polymerase III
分子名称: CHLORIDE ION, DNA polymerase III alpha subunit, MAGNESIUM ION, ...
著者Bailey, S, Wing, R.A, Steitz, T.A.
登録日2006-07-17
公開日2006-09-19
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献The Structure of T. aquaticus DNA Polymerase III Is Distinct from Eukaryotic Replicative DNA Polymerases.
Cell(Cambridge,Mass.), 126, 2006
2HRK
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Structural basis of yeast aminoacyl-tRNA synthetase complex formation revealed by crystal structures of two binary sub-complexes
分子名称: CHLORIDE ION, GU4 nucleic-binding protein 1, Glutamyl-tRNA synthetase, ...
著者Simader, H, Suck, D.
登録日2006-07-20
公開日2006-09-05
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Structural basis of yeast aminoacyl-tRNA synthetase complex formation revealed by crystal structures of two binary sub-complexes.
Nucleic Acids Res., 34, 2006
2NPB
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BU of 2npb by Molmil
NMR solution structure of mouse SelW
分子名称: Selenoprotein W
著者Aachmann, F.L, Fomenko, D.E, Soragni, A, Gladyshev, V.N, Dikiy, A.
登録日2006-10-27
公開日2006-11-14
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Solution structure of selenoprotein W and NMR analysis of its interaction with 14-3-3 proteins
J.Biol.Chem., 282, 2007
3AOA
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Structures of the multidrug exporter AcrB reveal a proximal multisite drug-binding pocket
分子名称: Acriflavine resistance protein B
著者Nakashima, R, Sakurai, K, Yamaguchi, A.
登録日2010-09-23
公開日2011-11-30
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (3.35 Å)
主引用文献Structures of the multidrug exporter AcrB reveal a proximal multisite drug-binding pocket
Nature, 480, 2011
2J4W
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Structure of a Plasmodium vivax apical membrane antigen 1-Fab F8.12.19 complex
分子名称: APICAL MEMBRANE ANTIGEN 1, FAB FRAGMENT OF MONOCLONAL ANTIBODY F8.12.19
著者Igonet, S, Vulliez-Le Normand, B, Faure, G, Riottot, M.M, Kocken, C.H.M, Thomas, A.W, Bentley, G.A.
登録日2006-09-07
公開日2007-01-30
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Cross-Reactivity Studies of an Anti-Plasmodium Vivax Apical Membrane Antigen 1 Monoclonal Antibody: Binding and Structural Characterisation.
J.Mol.Biol., 366, 2007
3AOB
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BU of 3aob by Molmil
Structures of the multidrug exporter AcrB reveal a proximal multisite drug-binding pocket
分子名称: Acriflavine resistance protein B, RIFAMPICIN
著者Nakashima, R, Sakurai, K, Yamaguchi, A.
登録日2010-09-23
公開日2011-11-30
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (3.35 Å)
主引用文献Structures of the multidrug exporter AcrB reveal a proximal multisite drug-binding pocket
Nature, 480, 2011
2YKH
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Sensor region of a sensor histidine kinase
分子名称: PROBABLE SENSOR HISTIDINE KINASE PDTAS
著者Preu, J, Panjikar, S, Morth, P, Jaiswal, R, Karunakar, P, Tucker, P.A.
登録日2011-05-27
公開日2012-06-06
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (2.78 Å)
主引用文献The Sensor Region of the Ubiquitous Cytosolic Sensor Kinase, Pdtas, Contains Pas and Gaf Domain Sensing Modules.
J.Struct.Biol., 177, 2012
2FN1
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BU of 2fn1 by Molmil
Crystal structures of Yersinia enterocolitica salicylate synthase (Irp9) in complex with the reaction products salicylate and pyruvate
分子名称: 2-HYDROXYBENZOIC ACID, MAGNESIUM ION, PYRUVIC ACID, ...
著者Kerbarh, O, Chirgadze, D.Y, Blundell, T.L, Abell, C.
登録日2006-01-10
公開日2006-02-14
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Crystal Structures of Yersinia enterocolitica Salicylate Synthase and its Complex with the Reaction Products Salicylate and Pyruvate.
J.Mol.Biol., 357, 2006
6Y11
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Respiratory complex I from Thermus thermophilus
分子名称: DUF3197 domain-containing protein, FE2/S2 (INORGANIC) CLUSTER, FLAVIN MONONUCLEOTIDE, ...
著者Gutierrez-Fernandez, J, Minhas, G.S, Sazanov, L.A.
登録日2020-02-10
公開日2020-09-02
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (3.109 Å)
主引用文献Key role of quinone in the mechanism of respiratory complex I.
Nat Commun, 11, 2020
4FBL
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BU of 4fbl by Molmil
LipS and LipT, two metagenome-derived lipolytic enzymes increase the diversity of known lipase and esterase families
分子名称: CHLORIDE ION, LipS lipolytic enzyme, SPERMIDINE
著者Chow, J, Krauss, U, Dall Antonia, Y, Fersini, F, Schmeisser, C, Schmidt, M, Menyes, I, Bornscheuer, U, Lauinger, B, Bongen, P, Pietruszka, J, Eckstein, M, Thum, O, Liese, A, Mueller-Dieckmann, J, Jaeger, K.-E, Kovacic, F, Streit, W.R, Structural Proteomics in Europe (SPINE)
登録日2012-05-23
公開日2012-10-10
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.99 Å)
主引用文献The Metagenome-Derived Enzymes LipS and LipT Increase the Diversity of Known Lipases.
Plos One, 7, 2012
2J5L
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Structure of a Plasmodium falciparum apical membrane antigen 1-Fab F8. 12.19 complex
分子名称: APICAL MEMBRANE ANTIGEN 1, FAB FRAGMENT OF MONOCLONAL ANTIBODY F8.12.19
著者Igonet, S, Vulliez-Le Normand, B, Faure, G, Riottot, M.M, Kocken, C.H.M, Thomas, A.W, Bentley, G.A.
登録日2006-09-18
公開日2007-01-30
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献Cross-Reactivity Studies of an Anti-Plasmodium Vivax Apical Membrane Antigen 1 Monoclonal Antibody: Binding and Structural Characterisation.
J.Mol.Biol., 366, 2007
4G2B
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BU of 4g2b by Molmil
Structure of the Catalytic Domain of the Salmonella Virulence Factor SseI
分子名称: Secreted effector protein sseI
著者Stebbins, C.E, Bhaskaran, S.S.
登録日2012-07-11
公開日2012-11-28
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Structure of the catalytic domain of the Salmonella virulence factor SseI.
Acta Crystallogr.,Sect.D, 68, 2012
4K7Q
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BU of 4k7q by Molmil
Crystal Structure of AcrB Complexed with Linezolid at 3.5 Resolution
分子名称: Acriflavine resistance protein B, N-{[(5S)-3-(3-fluoro-4-morpholin-4-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl}acetamide
著者Hung, L.W, Kim, H.B, Murakami, S, Gupta, G, Kim, C.Y, Terwilliger, T.C.
登録日2013-04-17
公開日2013-07-03
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (3.5 Å)
主引用文献Crystal structure of AcrB complexed with linezolid at 3.5 Angstrom resolution.
J.Struct.Funct.Genom., 14, 2013
6C94
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Structure Of Cytochrome P450 4B1 (CYP4B1) Complexed with the Inhibitor HET0016
分子名称: Cytochrome P450 4B1, N-(4-butyl-2-methylphenyl)-N'-hydroxyimidoformamide, PROTOPORPHYRIN IX CONTAINING FE
著者Hsu, M.-H, Johnson, E.F.
登録日2018-01-25
公開日2018-06-20
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.72 Å)
主引用文献Noncovalent interactions dominate dynamic heme distortion in cytochrome P450 4B1.
J. Biol. Chem., 293, 2018
4DS8
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Complex structure of abscisic acid receptor PYL3-(+)-ABA-HAB1 in the presence of Mn2+
分子名称: (2Z,4E)-5-[(1S)-1-hydroxy-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid, Abscisic acid receptor PYL3, GLYCEROL, ...
著者Zhang, X, Zhang, Q, Wang, G, Chen, Z.
登録日2012-02-18
公開日2012-06-06
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (2.21 Å)
主引用文献Complex Structures of the Abscisic Acid Receptor PYL3/RCAR13 Reveal a Unique Regulatory Mechanism
Structure, 20, 2012
3HZU
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Crystal structure of probable thiosulfate sulfurtransferase SSEA (rhodanese) from Mycobacterium tuberculosis
分子名称: GLYCEROL, SULFATE ION, Thiosulfate sulfurtransferase sseA
著者Seattle Structural Genomics Center for Infectious Disease (SSGCID)
登録日2009-06-24
公開日2009-07-07
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Mycobacterium thermoresistibile as a source of thermostable orthologs of Mycobacterium tuberculosis proteins.
Protein Sci., 21, 2012

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