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5T3A
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Maedi-Visna virus (MVV) integrase CCD-CTD (residues 60-275)
分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, ACETATE ION, integrase
著者Cook, N.J, Pye, V.E, Cherepanov, P.
登録日2016-08-25
公開日2017-01-18
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (2.501 Å)
主引用文献A supramolecular assembly mediates lentiviral DNA integration.
Science, 355, 2017
5T44
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Crystal structure of Frizzled 7 CRD
分子名称: Frizzled-7
著者Mukund, S, Nile, A.H, Stanger, K, Hannous, R.H, Wang, W.
登録日2016-08-29
公開日2017-04-05
最終更新日2017-05-03
実験手法X-RAY DIFFRACTION (1.9944 Å)
主引用文献Unsaturated fatty acyl recognition by Frizzled receptors mediates dimerization upon Wnt ligand binding.
Proc. Natl. Acad. Sci. U.S.A., 114, 2017
5SY6
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BU of 5sy6 by Molmil
Atomic resolution structure of human DJ-1, DTT bound
分子名称: 2,3-DIHYDROXY-1,4-DITHIOBUTANE, Protein deglycase DJ-1
著者Wilson, M.A, Lin, J.
登録日2016-08-10
公開日2016-12-28
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (1.15 Å)
主引用文献Short Carboxylic Acid-Carboxylate Hydrogen Bonds Can Have Fully Localized Protons.
Biochemistry, 56, 2017
5SZV
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Novel Structural Insights into GDP-Mediated Regulation of Acyl-CoA Thioesterases
分子名称: Acyl-CoA hydrolase, CHLORIDE ION, COENZYME A
著者Khandokar, Y.B, Srivastava, P, Forwood, J.K.
登録日2016-08-15
公開日2016-09-14
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Structural insights into GDP-mediated regulation of a bacterial acyl-CoA thioesterase.
J. Biol. Chem., 292, 2017
5T1A
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Structure of CC Chemokine Receptor 2 with Orthosteric and Allosteric Antagonists
分子名称: (2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, (2~{R})-1-(4-chloranyl-2-fluoranyl-phenyl)-2-cyclohexyl-3-ethanoyl-4-oxidanyl-2~{H}-pyrrol-5-one, (3S)-1-{(1S,2R,4R)-4-[methyl(propan-2-yl)amino]-2-propylcyclohexyl}-3-{[6-(trifluoromethyl)quinazolin-4-yl]amino}pyrrolidin-2-one, ...
著者Zheng, Y, Qin, L, Ortiz Zacarias, N.V, de Vries, H, Han, G.W, Gustavsson, M, Dabros, M, Zhao, C, Cherney, R.J, Carter, P, Stamos, D, Abagyan, R, Cherezov, V, Stevens, R.C, IJzerman, A.P, Heitman, L.H, Tebben, A, Kufareva, I, Handel, T.M.
登録日2016-08-18
公開日2016-12-14
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.806 Å)
主引用文献Structure of CC chemokine receptor 2 with orthosteric and allosteric antagonists.
Nature, 540, 2016
5SZY
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Novel Structural Insights into GDP-Mediated Regulation of Acyl-CoA Thioesterases
分子名称: Acyl-CoA hydrolase, CHLORIDE ION, COENZYME A, ...
著者Khandokar, Y.B, Srivastava, P, Forwood, J.K.
登録日2016-08-15
公開日2016-09-14
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Structural insights into GDP-mediated regulation of a bacterial acyl-CoA thioesterase.
J. Biol. Chem., 292, 2017
5T1Y
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MLA10 coiled-coil fragment
分子名称: MLA10, TRIETHYLENE GLYCOL
著者Williams, S.J, Kobe, B, Bentham, A, Ericsson, D.J.
登録日2016-08-22
公開日2016-11-02
最終更新日2016-11-23
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献The CC domain structure from the wheat stem rust resistance protein Sr33 challenges paradigms for dimerization in plant NLR proteins.
Proc.Natl.Acad.Sci.USA, 2016
5T1H
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Crystal structure of CK2
分子名称: 1,2-ETHANEDIOL, 7-(cyclopropylamino)-5-[3-(6-oxo-1,6-dihydropyridin-3-yl)thiophen-2-yl]pyrazolo[1,5-a]pyrimidine-3-carbonitrile, Casein kinase II subunit alpha, ...
著者Feguson, A.D.
登録日2016-08-19
公開日2017-11-22
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.11 Å)
主引用文献Crystal structure of CK2
To Be Published
5T2W
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Structure of thymine DNA glycosylase bound to substrate analog 2'-F-5-formyl-dC
分子名称: DNA (27-MER), DNA (28-MER), G/T mismatch-specific thymine DNA glycosylase
著者Pidugu, L.S, Pozharski, E, Drohat, A.C.
登録日2016-08-24
公開日2016-11-09
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Structural Basis for Excision of 5-Formylcytosine by Thymine DNA Glycosylase.
Biochemistry, 55, 2016
5T0Y
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2A10 Antibody FAB fragment
分子名称: 2A10 FAB fragment heavy chain, 2A10 FAB fragment light chain, SULFATE ION
著者Jackson, C.J, Fisher, C.
登録日2016-08-17
公開日2017-06-21
実験手法X-RAY DIFFRACTION (3.011 Å)
主引用文献Restricted antibody diversity and low affinity limit antibody responses to the Plasmodium circumsporozoite protein
To Be Published
5T1U
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Aminomethyl-Derived Beta Secretase (BACE1) Inhibitors: Engaging Gly230 without an Anilide Functionality
分子名称: (4S)-4-[2,4-difluoro-5-({[1-(trifluoromethyl)cyclopropyl]amino}methyl)phenyl]-4-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine, 1,2-ETHANEDIOL, Beta-secretase 1, ...
著者Parris, K.D, Vajdos, F.
登録日2016-08-22
公開日2017-01-11
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (1.78 Å)
主引用文献Aminomethyl-Derived Beta Secretase (BACE1) Inhibitors: Engaging Gly230 without an Anilide Functionality.
J. Med. Chem., 60, 2017
5T4Y
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Crystal structure of BT1762-1763
分子名称: MAGNESIUM ION, SusC homolog, SusD homolog
著者van den Berg, B.
登録日2016-08-30
公開日2016-12-14
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (3.1 Å)
主引用文献Structural basis for nutrient acquisition by dominant members of the human gut microbiota.
Nature, 541, 2017
5T6C
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BU of 5t6c by Molmil
Crystal structure of Aspergillus fumigatus N-myristoyl transferase in complex with myristoyl CoA and a dichloro-methylpyridinyl-methoxy-phenyl-pyridine piperazine ligand
分子名称: 1-(4-{3,5-dichloro-4-[(2-methylpyridin-3-yl)methoxy]phenyl}pyridin-2-yl)piperazine, Glycylpeptide N-tetradecanoyltransferase, TETRADECANOYL-COA
著者Robinson, D.A, Wyatt, P.G.
登録日2016-09-01
公開日2017-09-13
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Design and Synthesis of Brain Penetrant Trypanocidal N-Myristoyltransferase Inhibitors.
J. Med. Chem., 60, 2017
5T2T
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BU of 5t2t by Molmil
Crystal structure of Lymphocytic choriomeningitis mammarenavirus endonuclease bound to compound L742001
分子名称: (2Z)-4-[1-benzyl-4-(4-chlorobenzyl)piperidin-4-yl]-2-hydroxy-4-oxobut-2-enoic acid, CHLORIDE ION, GLYCEROL, ...
著者Saez-Ayala, M, Yekwa, E.L, Canard, B, Alvarez, K, Ferron, F.
登録日2016-08-24
公開日2017-09-13
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.967 Å)
主引用文献Crystal structures ofLymphocytic choriomeningitis virusendonuclease domain complexed with diketo-acid ligands.
IUCrJ, 5, 2018
5T3Z
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BU of 5t3z by Molmil
3.5 Angstrom Crystal Structure of a Fully and Natively Glycosylated BG505 SOSIP.664 HIV-1 Env Trimer in Complex with the Broadly Neutralizing Antibodies IOMA and 10-1074
分子名称: 10-1074 Heavy Chain, 10-1074 Light Chain, 2-acetamido-2-deoxy-beta-D-glucopyranose, ...
著者Gristick, H.B, Bjorkman, P.J.
登録日2016-08-26
公開日2016-10-05
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (3.5 Å)
主引用文献Natively glycosylated HIV-1 Env structure reveals new mode for antibody recognition of the CD4-binding site.
Nat.Struct.Mol.Biol., 23, 2016
5T7U
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BU of 5t7u by Molmil
Crystal structure of galectin-8N in complex with Glycerol
分子名称: CHLORIDE ION, GLYCEROL, Galectin-8, ...
著者Bohari, M.H, Yu, X, Blanchard, H.
登録日2016-09-05
公開日2017-01-04
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (1.58 Å)
主引用文献Structure-based rationale for differential recognition of lacto- and neolacto- series glycosphingolipids by the N-terminal domain of human galectin-8.
Sci Rep, 6, 2016
5T84
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BU of 5t84 by Molmil
HIV-1 protease, unbound subtype B L63P construct
分子名称: Protease
著者Liu, Z, Norell, J, Mahon, B, Poole, K, McKenna, R, Fanucci, G.
登録日2016-09-06
公開日2017-09-20
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Single mutation, L63P, capable of shutting down the flaps of HIV-1 protease
To Be Published
5T6A
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BU of 5t6a by Molmil
Crystal Structure of TgCDPK1 from toxoplasma gondii complexed with 5GA
分子名称: 4-(3-chloro-4-fluorophenyl)-5-(1,5-naphthyridin-2-yl)-1,3-thiazol-2-amine, Calmodulin-domain protein kinase 1
著者Jiang, D.Q, Tempel, W, Loppnau, P, Walker, J.R, Graslund, S, Arrowsmith, C.H, Edwards, A.M, Bountra, C, Hui, R, Lovato, D.V, Osman, K.T, Structural Genomics Consortium (SGC)
登録日2016-09-01
公開日2016-11-02
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Crystal Structure of TgCDPK1 from toxoplasma gondii complexed with SGC-1-9
to be published
5T6I
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CRYSTAL STRUCTURE OF TGCDPK1 FROM TOXOPLASMA GONDII COMPLEXED WITH 5GB
分子名称: 4-(3-methylphenyl)-5-(1,5-naphthyridin-2-yl)-1,3-thiazol-2-amine, Calmodulin-domain protein kinase 1
著者Jiang, D.Q, Tempel, W, Walker, J.R, El Bakkouri, M, Loppnau, P, Graslund, S, Arrowsmith, C.H, Edwards, A.M, Bountra, C, Hui, R, Lovato, D.V, Osman, K.T, Structural Genomics Consortium (SGC)
登録日2016-09-01
公開日2016-11-02
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Crystal Structure of CDPK1 from toxoplasma gondii complexed with SGC-1-19
to be published
5T96
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Crystal structure of the infectious salmon anemia virus (ISAV) HE viral receptor complex
分子名称: 4-O-acetyl-5-acetamido-3,5-dideoxy-L-glycero-alpha-D-galacto-non-2-ulopyranosonic acid, FORMIC ACID, GLYCEROL, ...
著者Cook, J.D, Sultana, A, Lee, J.E.
登録日2016-09-09
公開日2017-03-22
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Structure of the infectious salmon anemia virus receptor complex illustrates a unique binding strategy for attachment.
Proc. Natl. Acad. Sci. U.S.A., 114, 2017
5TC2
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C-terminal domain of HIV-1 integrase, crystal structure
分子名称: GLYCEROL, integrase
著者Tsirkone, V.G, Strelkov, S.V.
登録日2016-09-14
公開日2018-04-04
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.84 Å)
主引用文献Interaction of TRN-SR2 with HIV Integrase
To Be Published
5TC4
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Crystal structure of human mitochondrial methylenetetrahydrofolate dehydrogenase-cyclohydrolase (MTHFD2) in complex with LY345899 and cofactors
分子名称: 4-(7-AMINO-9-HYDROXY-1-OXO-3,3A,4,5-TETRAHYDRO-2,5,6,8,9B-PENTAAZA-CYCLOPENTA[A]NAPHTHALEN-2-YL)-PHENYLCARBONYL-GLUTAMI C ACID, Bifunctional methylenetetrahydrofolate dehydrogenase/cyclohydrolase, mitochondrial, ...
著者Gustafsson, R, Jemth, A.-S, Gustafsson Sheppard, N, Farnegardh, K, Loseva, O, Wiita, E, Bonagas, N, Dahllund, L, Llona-Minguez, S, Haggblad, M, Henriksson, M, Andersson, Y, Homan, E, Helleday, T, Stenmark, P.
登録日2016-09-14
公開日2016-12-14
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.89 Å)
主引用文献Crystal Structure of the Emerging Cancer Target MTHFD2 in Complex with a Substrate-Based Inhibitor.
Cancer Res., 77, 2017
5TFX
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New method for synthesis of benzoxazole amide inhibitors of carbonic anhydrase
分子名称: Carbonic anhydrase 2, GLYCEROL, N-(5-sulfamoyl-1,3-benzoxazol-2-yl)benzamide, ...
著者Peat, T.S, Supuran, C.
登録日2016-09-26
公開日2017-08-09
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Intramolecular oxidative deselenization of acylselenoureas: a facile synthesis of benzoxazole amides and carbonic anhydrase inhibitors.
Org. Biomol. Chem., 14, 2016
5TC9
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Wild type TrCel7A catalytic domain in a closed state
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, GADOLINIUM ION, Glucanase, ...
著者Bodenheimer, A.M, Meilleur, F.
登録日2016-09-14
公開日2017-01-04
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Crystal structures of wild-type Trichoderma reesei Cel7A catalytic domain in open and closed states.
FEBS Lett., 590, 2016
5TD8
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Crystal structure of an Extended Dwarf Ndc80 Complex
分子名称: Kinetochore protein NDC80, Kinetochore protein NUF2, Kinetochore protein SPC24, ...
著者Valverde, R, Ingram, J, Harrison, S.C.
登録日2016-09-17
公開日2016-11-16
最終更新日2019-11-20
実験手法X-RAY DIFFRACTION (7.531 Å)
主引用文献Conserved Tetramer Junction in the Kinetochore Ndc80 Complex.
Cell Rep, 17, 2016

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