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4AGE
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BU of 4age by Molmil
MTSSL spin labeled D67C mutant of MscS in the open form
分子名称: SMALL-CONDUCTANCE MECHANOSENSITIVE CHANNEL
著者Pliotas, C, Brannigan, E, Naismith, J.H.
登録日2012-01-26
公開日2012-08-15
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (4.84 Å)
主引用文献Conformational State of the Mscs Mechanosensitive Channel in Solution Revealed by Pulsed Electron-Electron Double Resonance (Peldor) Spectroscopy.
Proc.Natl.Acad.Sci.USA, 109, 2012
4AGF
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BU of 4agf by Molmil
MTSSL spin labeled L124C mutant of MscS in the open form
分子名称: SMALL-CONDUCTANCE MECHANOSENSITIVE CHANNEL
著者Pliotas, C, Brannigan, E, Naismith, J.H.
登録日2012-01-26
公開日2012-08-15
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (4.7 Å)
主引用文献Conformational State of the Mscs Mechanosensitive Channel in Solution Revealed by Pulsed Electron-Electron Double Resonance (Peldor) Spectroscopy.
Proc.Natl.Acad.Sci.USA, 109, 2012
5AGC
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BU of 5agc by Molmil
Crystallographic forms of the Vps75 tetramer
分子名称: VACUOLAR PROTEIN SORTING-ASSOCIATED PROTEIN 75
著者Hammond, C.M, Sundaramoorthy, R, Owen-Hughes, T.
登録日2015-01-29
公開日2016-03-02
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (4 Å)
主引用文献The Histone Chaperone Vps75 Forms Multiple Oligomeric Assemblies Capable of Mediating Exchange between Histone H3-H4 Tetramers and Asf1-H3-H4 Complexes.
Nucleic Acids Res., 44, 2016
8SBE
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BU of 8sbe by Molmil
Structure of the rat vesicular glutamate transporter 2 determined by single-particle Cryo-EM
分子名称: Vesicular glutamate transporter 2
著者Li, F, Finer-Moore, J, Eriksen, J, Cheng, Y, Edwards, R, Stroud, R.
登録日2023-04-03
公開日2023-05-03
最終更新日2024-06-19
実験手法ELECTRON MICROSCOPY (3.8 Å)
主引用文献Ion transport and regulation in a synaptic vesicle glutamate transporter.
Science, 368, 2020
8ATG
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BU of 8atg by Molmil
Pentameric ligand-gated ion channel GLIC with bound lipids
分子名称: (2S)-3-(hexadecanoyloxy)-2-[(9Z)-octadec-9-enoyloxy]propyl 2-(trimethylammonio)ethyl phosphate, Proton-gated ion channel
著者Bergh, C, Rovsnik, U, Howard, R.J, Lindahl, E.
登録日2022-08-23
公開日2023-09-06
最終更新日2024-03-20
実験手法ELECTRON MICROSCOPY (2.9 Å)
主引用文献Discovery of lipid binding sites in a ligand-gated ion channel by integrating simulations and cryo-EM.
Elife, 12, 2024
8U1D
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BU of 8u1d by Molmil
Cryo-EM structure of vaccine-elicited CD4 binding site antibody DH1285 bound to HIV-1 CH505TFchim.6R.SOSIP.664v4.1 Env Local Refinement
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, DH1285 Heavy Chain, DH1285 Light Chain, ...
著者Thakur, B, Stalls, V.D, Acharya, P.
登録日2023-08-31
公開日2024-01-03
最終更新日2024-07-17
実験手法ELECTRON MICROSCOPY (4.25 Å)
主引用文献Vaccine induction of CD4-mimicking HIV-1 broadly neutralizing antibody precursors in macaques.
Cell, 187, 2024
8SXI
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BU of 8sxi by Molmil
CH505 Disulfide Stapled SOSIP Bound to b12 Fab
分子名称: Envelope glycoprotein gp160, HIV-1 gp41, b12 Heavy Chain, ...
著者Henderson, R.
登録日2023-05-22
公開日2024-02-14
実験手法ELECTRON MICROSCOPY (4.5 Å)
主引用文献Microsecond dynamics control the HIV-1 Envelope conformation.
Sci Adv, 10, 2024
8SXJ
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BU of 8sxj by Molmil
CH505 Disulfide Stapled SOSIP Bound to CH235.12 Fab
分子名称: CH235.12 Heavy Chain, CH235.12 Light Chain, Envelope glycoprotein gp160, ...
著者Henderson, R.
登録日2023-05-22
公開日2024-02-14
実験手法ELECTRON MICROSCOPY (4 Å)
主引用文献Microsecond dynamics control the HIV-1 Envelope conformation.
Sci Adv, 10, 2024
7OBO
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BU of 7obo by Molmil
GSTF1 from Alopecurus myosuroides
分子名称: (2~{S})-2-azanyl-5-[[(2~{R})-1-(2-hydroxy-2-oxoethylamino)-3-[(7-nitro-2,1,3-benzoxadiazol-4-yl)sulfanyl]-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid, Glutathione transferase
著者Pohl, E, Eno, R.F.M, Freitag-Pohl, S.
登録日2021-04-23
公開日2022-04-20
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Flavonoid-based inhibitors of the Phi-class glutathione transferase from black-grass to combat multiple herbicide resistance.
Org.Biomol.Chem., 19, 2021
7ODM
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BU of 7odm by Molmil
AmGSTF1 Y118S variant
分子名称: Glutathione transferase, [(2~{S})-5-[[(2~{R})-1-(2-hydroxy-2-oxoethylamino)-1-oxidanylidene-3-sulfanyl-propan-2-yl]amino]-1-oxidanyl-1,5-bis(oxidanylidene)pentan-2-yl]azanium
著者Pohl, E, Eno, R.F.M.
登録日2021-04-30
公開日2022-04-20
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Flavonoid-based inhibitors of the Phi-class glutathione transferase from black-grass to combat multiple herbicide resistance.
Org.Biomol.Chem., 19, 2021
1E6B
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BU of 1e6b by Molmil
Crystal structure of a Zeta class glutathione S-transferase from Arabidopsis thaliana
分子名称: BETA-MERCAPTOETHANOL, GLUTATHIONE S-TRANSFERASE
著者Thom, R, Lapthorn, A.J.
登録日2000-08-10
公開日2001-06-11
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献The Structure of a Zeta Class Glutathione S-Transferase from Arabidopsis Thaliana: Characterisation of a Gst with Novel Active-Site Architecture and a Putative Role in Tyrosine Catabolism.
J.Mol.Biol., 308, 2001
6TO3
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BU of 6to3 by Molmil
GSTF1 from Alopecurus myosuroides - covalently modified
分子名称: 4-chloro-7-nitrobenzofurazan, Glutathione transferase
著者Pohl, E, Eno, R.F.M, Freitag-Pohl, S.
登録日2019-12-11
公開日2021-08-18
最終更新日2022-08-31
実験手法X-RAY DIFFRACTION (2.798 Å)
主引用文献Flavonoid-based inhibitors of the Phi-class glutathione transferase from black-grass to combat multiple herbicide resistance.
Org.Biomol.Chem., 19, 2021
3L6D
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BU of 3l6d by Molmil
Crystal structure of putative oxidoreductase from Pseudomonas putida KT2440
分子名称: Putative oxidoreductase
著者Malashkevich, V.N, Patskovsky, Y, Toro, R, Sauder, J.M, Burley, S.K, Almo, S.C, New York SGX Research Center for Structural Genomics (NYSGXRC)
登録日2009-12-23
公開日2010-01-12
最終更新日2021-02-10
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Crystal structure of putative oxidoreductase from Pseudomonas putida KT2440
To be Published
3LCC
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BU of 3lcc by Molmil
Structure of a SAM-dependent halide methyltransferase from Arabidopsis thaliana
分子名称: CHLORIDE ION, Putative methyl chloride transferase, S-ADENOSYL-L-HOMOCYSTEINE
著者Schmidberger, J.W, O'Hagan, D, Naismith, J.H.
登録日2010-01-10
公開日2010-05-19
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Halomethane Biosynthesis: Structure of a SAM-Dependent Halide Methyltransferase from Arabidopsis thaliana
Angew.Chem.Int.Ed.Engl., 49, 2010
5ELA
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BU of 5ela by Molmil
The structure of DHAR1 from Arabidopsis thaliana
分子名称: GLYCEROL, Glutathione S-transferase DHAR1, mitochondrial
著者Menault, M, Roszak, A.W, Lapthorn, A.J.
登録日2015-11-04
公開日2016-11-16
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.28 Å)
主引用文献Arabidopsis thaliana DHAR1 apo structure
To Be Published
5ELG
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BU of 5elg by Molmil
The structure of DHAR1 from Arabidopsis thaliana
分子名称: GLUTATHIONE, GLYCEROL, Glutathione S-transferase DHAR1, ...
著者Menault, M, Roszak, A.W, Lapthorn, A.J.
登録日2015-11-04
公開日2016-11-16
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.81 Å)
主引用文献Arabidopsis thaliana DHAR1 apo structure
To Be Published
5EL8
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BU of 5el8 by Molmil
The structure of DHAR1 from Arabidopsis thaliana
分子名称: GLYCEROL, Glutathione S-transferase DHAR1, mitochondrial
著者Menault, M, Roszak, A.W, Lapthorn, A.J.
登録日2015-11-04
公開日2016-11-16
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Arabidopsis thaliana DHAR1 apo structure
To Be Published
3UEN
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BU of 3uen by Molmil
Crystal structure of TopBP1 BRCT4/5 domains
分子名称: DNA topoisomerase 2-binding protein 1, GLYCEROL, THIOCYANATE ION
著者Leung, C.C, Glover, J.N.M.
登録日2011-10-31
公開日2013-07-03
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Structural insights into recognition of MDC1 by TopBP1 in DNA replication checkpoint control.
Structure, 21, 2013
3UEO
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BU of 3ueo by Molmil
Crystal structure of TopBP1 BRCT4/5 domains in complex with a phospho-peptide
分子名称: DNA topoisomerase 2-binding protein 1, phospho-peptide
著者Leung, C.C, Glover, J.N.M.
登録日2011-10-31
公開日2013-07-03
最終更新日2014-03-26
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Structural insights into recognition of MDC1 by TopBP1 in DNA replication checkpoint control.
Structure, 21, 2013
3B2R
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BU of 3b2r by Molmil
Crystal Structure of PDE5A1 catalytic domain in complex with Vardenafil
分子名称: 2-{2-ETHOXY-5-[(4-ETHYLPIPERAZIN-1-YL)SULFONYL]PHENYL}-5-METHYL-7-PROPYLIMIDAZO[5,1-F][1,2,4]TRIAZIN-4(1H)-ONE, cGMP-specific 3',5'-cyclic phosphodiesterase
著者Huanchen, W, Mengchun, Y, Howard, R, Sharron, H.F, Hengming, K.
登録日2007-10-19
公開日2008-05-20
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2.07 Å)
主引用文献Conformational variations of both phosphodiesterase-5 and inhibitors provide the structural basis for the physiological effects of vardenafil and sildenafil.
Mol.Pharmacol., 73, 2008
3BJC
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BU of 3bjc by Molmil
Crystal structure of the PDE5A catalytic domain in complex with a novel inhibitor
分子名称: 5-ethoxy-4-(1-methyl-7-oxo-3-propyl-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl)thiophene-2-sulfonamide, MAGNESIUM ION, ZINC ION, ...
著者Chen, G, Wang, H, Howard, R, Cai, J, Wan, Y, Ke, H.
登録日2007-12-03
公開日2008-04-29
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献An insight into the pharmacophores of phosphodiesterase-5 inhibitors from synthetic and crystal structural studies
BIOCHEM.PHARM., 75, 2008
5SYD
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BU of 5syd by Molmil
Circularly permutated azurin (cpAz) based on P. aeruginosa azurin sequence
分子名称: Azurin, chimeric construct, COPPER (II) ION
著者Petrik, I, Yang, Y, Howard, R, Yi, L.
登録日2016-08-10
公開日2017-08-16
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.397 Å)
主引用文献Circular Permutation of Azurin Results in the same Type 1 Blue Copper with different Reduction Potentials
To Be Published
5UA3
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BU of 5ua3 by Molmil
Crystal Structure of a DNA G-Quadruplex with a Cytosine Bulge
分子名称: DNA (5'-D(*GP*GP*GP*TP*TP*GP*CP*GP*GP*AP*GP*GP*GP*TP*GP*GP*GP*CP*CP*T)-3'), POTASSIUM ION
著者Meier, M, McDougall, M.D, Krahn, N.J, Moya-Torres, A, McRae, E.K.S, Booy, E.P, Patel, T.R, McKenna, S.A, Stetefeld, J.
登録日2016-12-18
公開日2017-11-22
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (1.8802 Å)
主引用文献Structure and hydrodynamics of a DNA G-quadruplex with a cytosine bulge.
Nucleic Acids Res., 46, 2018
2YEK
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BU of 2yek by Molmil
Crystal Structure of the First Bromodomain of Human Brd2 with the inhibitor GSK525762 (IBET)
分子名称: 2-[(4S)-6-(4-chlorophenyl)-8-methoxy-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-4-yl]-N-ethylacetamide, BROMODOMAIN-CONTAINING PROTEIN 2, SULFATE ION
著者Chung, C.W.
登録日2011-03-25
公開日2011-06-15
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.98 Å)
主引用文献Discovery and Characterization of Small Molecule Inhibitors of the Bet Family Bromodomains.
J.Med.Chem., 54, 2011
2YEL
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BU of 2yel by Molmil
Crystal Structure of the First Bromodomain of Human Brd4 with the inhibitor GW841819X
分子名称: 1,2-ETHANEDIOL, BENZYL [(4R)-1-METHYL-6-PHENYL-4H-[1,2,4]TRIAZOLO[4,3-A][1,4]BENZODIAZEPIN-4-YL]CARBAMATE, HUMAN BRD4
著者Chung, C.W.
登録日2011-03-25
公開日2011-06-15
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Discovery and Characterization of Small Molecule Inhibitors of the Bet Family Bromodomains.
J.Med.Chem., 54, 2011

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