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4ZBI
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Mcl-1 complexed with small molecules
分子名称: 1-[3-(naphthalen-1-yloxy)propyl]-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-2-carboxylic acid, Induced myeloid leukemia cell differentiation protein Mcl-1
著者Zhao, B.
登録日2015-04-14
公開日2015-04-29
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Discovery of tricyclic indoles that potently inhibit mcl-1 using fragment-based methods and structure-based design.
J.Med.Chem., 58, 2015
3EAZ
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BU of 3eaz by Molmil
Crystal structure of SH2 domain of Human Csk (carboxyl-terminal src kinase), C122S mutant.
分子名称: Tyrosine-protein kinase CSK
著者Liu, D, Seidel, R.D, Cowburn, D.
登録日2008-08-26
公開日2009-11-10
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (1.31 Å)
主引用文献Combining biophysical methods to analyze the disulfide bond in SH2 domain of C-terminal Src kinase.
Biophys Rep, 2, 2016
3GIN
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BU of 3gin by Molmil
Crystal structure of E454K-CBD1
分子名称: CALCIUM ION, Sodium/calcium exchanger 1
著者Chaptal, V, Mercado-Besserer, G, Abramson, J.
登録日2009-03-05
公開日2009-04-21
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Structure and functional analysis of a Ca2+ sensor mutant of the na+/ca2+ exchanger
J.Biol.Chem., 284, 2009
3FHO
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BU of 3fho by Molmil
Structure of S. pombe Dbp5
分子名称: ATP-dependent RNA helicase dbp5
著者Cheng, Z, Song, H.
登録日2008-12-09
公開日2009-10-13
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Solution and crystal structures of mRNA exporter Dbp5p and its interaction with nucleotides
J.Mol.Biol., 388, 2009
4A55
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BU of 4a55 by Molmil
Crystal structure of p110alpha in complex with iSH2 of p85alpha and the inhibitor PIK-108
分子名称: PHOSPHATIDYLINOSITOL 3-KINASE REGULATORY SUBUNIT ALPHA, PHOSPHATIDYLINOSITOL-4,5-BISPHOSPHATE 3-KINASE CATALYTIC SUBUNIT ALPHA ISOFORM, PIK-108
著者Hon, W.-C, Berndt, A, Williams, R.L.
登録日2011-10-24
公開日2011-12-28
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (3.5 Å)
主引用文献Regulation of Lipid Binding Underlies the Activation Mechanism of Class Ia Pi3-Kinases.
Oncogene, 31, 2012
3GAU
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BU of 3gau by Molmil
Solution structure of Human Complement Factor H in 50 mM NaCl buffer
分子名称: Complement factor H
著者Okemefuna, A.I, Nan, R, Gor, J, Perkins, S.J.
登録日2009-02-18
公開日2009-06-09
最終更新日2024-02-21
実験手法SOLUTION SCATTERING
主引用文献Electrostatic interactions contribute to the folded-back conformation of wild type human factor H.
J.Mol.Biol., 391, 2009
8EZD
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BU of 8ezd by Molmil
Brain-derived 42-residue amyloid-beta fibril type A
分子名称: Beta-amyloid protein 42
著者Tycko, R, Lee, M, Yau, Y.-M, Louis, J.M.
登録日2022-10-31
公開日2023-03-22
最終更新日2024-06-19
実験手法ELECTRON MICROSCOPY (2.83 Å)
主引用文献Structures of brain-derived 42-residue amyloid-beta fibril polymorphs with unusual molecular conformations and intermolecular interactions.
Proc.Natl.Acad.Sci.USA, 120, 2023
8EZE
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BU of 8eze by Molmil
Brain-derived 42-residue amyloid-beta fibril type B
分子名称: Beta-amyloid protein 42
著者Tycko, R, Lee, M, Yau, Y.-M, Louis, J.M.
登録日2022-10-31
公開日2023-03-22
最終更新日2024-06-19
実験手法ELECTRON MICROSCOPY (2.76 Å)
主引用文献Structures of brain-derived 42-residue amyloid-beta fibril polymorphs with unusual molecular conformations and intermolecular interactions.
Proc.Natl.Acad.Sci.USA, 120, 2023
3GGW
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BU of 3ggw by Molmil
Crystal Structure of FAB F22-4 in complex with a Carbohydrate-mimetic peptide
分子名称: FAB F22-4 HEAVY CHAIN, FAB F22-4 LIGHT CHAIN, PEPTIDE B1
著者Saul, F.A, Vulliez-Le Normand, B, Bentley, G.A.
登録日2009-03-02
公開日2009-03-31
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Structural Mimicry of O-Antigen by a Peptide Revealed in a Complex with an Antibody Raised against Shigella flexneri Serotype 2a
J.Mol.Biol., 388, 2009
3GAV
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BU of 3gav by Molmil
Solution structure of Human Complement Factor H in 137 mM NaCl buffer
分子名称: Complement factor H
著者Okemefuna, A.I, Nan, R, Gor, J, Perkins, S.J.
登録日2009-02-18
公開日2009-06-09
最終更新日2024-02-21
実験手法SOLUTION SCATTERING
主引用文献Electrostatic interactions contribute to the folded-back conformation of wild type human factor H.
J.Mol.Biol., 391, 2009
3GAW
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BU of 3gaw by Molmil
Solution structure of Human Complement Factor H in 250 mM NaCl buffer
分子名称: Complement factor H
著者Okemefuna, A.I, Nan, R, Gor, J, Perkins, S.J.
登録日2009-02-18
公開日2009-06-09
最終更新日2024-02-21
実験手法SOLUTION SCATTERING
主引用文献Electrostatic interactions contribute to the folded-back conformation of wild type human factor H.
J.Mol.Biol., 391, 2009
3HQB
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BU of 3hqb by Molmil
Crystal structure of human desarg-C5A
分子名称: Complement C5
著者Cook, W.J, Ealick, S.E.
登録日2009-06-05
公開日2010-02-02
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (3.299 Å)
主引用文献Structure of human desArg-C5a.
Acta Crystallogr.,Sect.D, 66, 2010
3HQA
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BU of 3hqa by Molmil
Crystal structure of human desarg-C5A
分子名称: Complement C5
著者Cook, W.J, Ealick, S.E.
登録日2009-06-05
公開日2010-02-02
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (2.586 Å)
主引用文献Structure of human desArg-C5a.
Acta Crystallogr.,Sect.D, 66, 2010
4AGW
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BU of 4agw by Molmil
Discovery of a small molecule type II inhibitor of wild-type and gatekeeper mutants of BCR-ABL, PDGFRalpha, Kit, and Src kinases
分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, 3-{2-[(cyclopropylcarbonyl)amino][1,3]thiazolo[5,4-b]pyridin-5-yl}-N-{4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromet hyl)phenyl}benzamide, GLYCEROL, ...
著者Weisberg, E, Choi, H.G, Seeliger, M, Gray, N, Griffin, J.D.
登録日2012-02-01
公開日2012-02-15
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Discovery of a Small-Molecule Type II Inhibitor of Wild-Type and Gatekeeper Mutants of Bcr-Abl, Pdgfralpha, Kit, and Src Kinases: Novel Type II Inhibitor of Gatekeeper Mutants.
Blood, 115, 2010
3EAC
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BU of 3eac by Molmil
Crystal structure of SH2 domain of Human Csk (carboxyl-terminal src kinase), Oxidized form.
分子名称: Tyrosine-protein kinase CSK
著者Liu, D, Seidel, R.D, Cowburn, D.
登録日2008-08-25
公開日2009-11-10
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (1.37 Å)
主引用文献Combining biophysical methods to analyze the disulfide bond in SH2 domain of C-terminal Src kinase.
Biophys Rep, 2, 2016
3LNX
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BU of 3lnx by Molmil
Second PDZ domain from human PTP1E
分子名称: IODIDE ION, THIOCYANATE ION, Tyrosine-protein phosphatase non-receptor type 13
著者Zhang, J, Chang, A, Ke, H, Phillips Jr, G.N, Lee, A.L, Center for Eukaryotic Structural Genomics (CESG)
登録日2010-02-03
公開日2010-02-23
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (1.642 Å)
主引用文献Crystallographic and nuclear magnetic resonance evaluation of the impact of peptide binding to the second PDZ domain of protein tyrosine phosphatase 1E.
Biochemistry, 49, 2010
3E0U
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BU of 3e0u by Molmil
Crystal structure of T. cruzi GPX1
分子名称: AMMONIUM ION, GLYCEROL, Glutathione peroxidase
著者Patel, S.H, Hussain, S, Harris, R, Driscoll, P, Djordjevic, S.
登録日2008-08-01
公開日2009-08-04
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Structural insights into the catalytic mechanism of Trypanosoma cruzi GPXI (glutathione peroxidase-like enzyme I).
Biochem.J., 425, 2010
6R3M
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BU of 6r3m by Molmil
Family 11 Carbohydrate-Binding Module from Clostridium thermocellum in complex with beta-1,3-1,4-mixed-linked tetrasaccharide
分子名称: ACETATE ION, CALCIUM ION, Endoglucanase H, ...
著者Ribeiro, D.O, Carvalho, A.L.
登録日2019-03-20
公開日2020-02-05
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.45 Å)
主引用文献Molecular basis for the preferential recognition of beta 1,3-1,4-glucans by the family 11 carbohydrate-binding module from Clostridium thermocellum.
Febs J., 287, 2020
6R4W
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BU of 6r4w by Molmil
Crystal structure of apo PPEP-1(E143A/Y178F) in complex with substrate peptide Ac-EVNAPVP-CONH2
分子名称: ACE-GLU-VAL-ASN-ALA-PRO-VAL-LPD, Pro-Pro endopeptidase, ZINC ION
著者Pichlo, C, Baumann, U.
登録日2019-03-24
公開日2019-06-12
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.391 Å)
主引用文献Molecular determinants of the mechanism and substrate specificity ofClostridium difficileproline-proline endopeptidase-1.
J.Biol.Chem., 294, 2019
6R56
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BU of 6r56 by Molmil
Crystal structure of PPEP-1(K101E/E184K)
分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Pro-Pro endopeptidase, ZINC ION
著者Pichlo, C, Baumann, U.
登録日2019-03-24
公開日2019-06-12
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.77 Å)
主引用文献Molecular determinants of the mechanism and substrate specificity ofClostridium difficileproline-proline endopeptidase-1.
J.Biol.Chem., 294, 2019
6R4Z
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BU of 6r4z by Molmil
Crystal structure of holo PPEP-1(E143A/Y178F) in complex with product peptide Ac-EVNP-CO2 (substrate peptide: Ac-EVNPPVP-CONH2)
分子名称: ACE-GLU-VAL-ASN-PRO, NICKEL (II) ION, Pro-Pro endopeptidase, ...
著者Pichlo, C, Baumann, U.
登録日2019-03-24
公開日2019-06-12
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.052 Å)
主引用文献Molecular determinants of the mechanism and substrate specificity ofClostridium difficileproline-proline endopeptidase-1.
J.Biol.Chem., 294, 2019
6R59
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BU of 6r59 by Molmil
Crystal structure of PPEP-1(E143A/Y178F) in complex with substrate peptide Ac-EVAPPVP-NH2
分子名称: ACE-GLU-VAL-ALA-PRO-PRO-VAL-LPD, Pro-Pro endopeptidase, ZINC ION
著者Pichlo, C, Baumann, U.
登録日2019-03-24
公開日2019-06-12
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Molecular determinants of the mechanism and substrate specificity ofClostridium difficileproline-proline endopeptidase-1.
J.Biol.Chem., 294, 2019
6LF1
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BU of 6lf1 by Molmil
SeviL, a GM1b/asialo-GM1 binding lectin
分子名称: CHLORIDE ION, SeviL
著者Kamata, K, Ozeki, Y, Park, S.-Y, Tame, J.R.H.
登録日2019-11-28
公開日2020-12-02
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献The structure of SeviL, a GM1b/asialo-GM1 binding R-type lectin from the mussel Mytilisepta virgata.
Sci Rep, 10, 2020
5HS7
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BU of 5hs7 by Molmil
Reduced form of the transcriptional regulator YodB from B. subtilis
分子名称: GLYCEROL, HTH-type transcriptional regulator YodB
著者Lee, S.J, Lee, I.G, Lee, B.J.
登録日2016-01-25
公開日2016-08-17
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Two distinct mechanisms of transcriptional regulation by the redox sensor YodB
Proc.Natl.Acad.Sci.USA, 113, 2016
6R36
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T. brucei farnesyl pyrophosphate synthase (FPPS)
分子名称: DI(HYDROXYETHYL)ETHER, DIMETHYL SULFOXIDE, Farnesyl pyrophosphate synthase
著者Muenzker, L, Petrick, J.K, Schleberger, C, Jahnke, W.
登録日2019-03-19
公開日2020-04-08
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.67 Å)
主引用文献Fragment-Based Discovery of Non-bisphosphonate Binders of Trypanosoma brucei Farnesyl Pyrophosphate Synthase.
Chembiochem, 21, 2020

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