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5LSQ
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Ethylene Forming Enzyme from Pseudomonas syringae pv. phaseolicola - I222 crystal form
分子名称: 2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CHLORIDE ION, Ethylene Forming Enzyme, ...
著者Zhang, Z, McDonough, M.A, Schofield, C.J.
登録日2016-09-05
公開日2017-04-19
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献Structural and stereoelectronic insights into oxygenase-catalyzed formation of ethylene from 2-oxoglutarate.
Proc. Natl. Acad. Sci. U.S.A., 114, 2017
8ERF
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BU of 8erf by Molmil
HTLV-1 capsid protein N-terminal domain orthorhombic crystal form
分子名称: SULFATE ION, capsid protein p24
著者Yu, R.J, Li, N, Jacques, D.A.
登録日2022-10-11
公開日2023-10-18
実験手法X-RAY DIFFRACTION (1.47 Å)
主引用文献HTLV-1 capsid protein N-terminal domain orthorhombic crystal form
To Be Published
5LGT
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BU of 5lgt by Molmil
Thieno[3,2-b]pyrrole-5-carboxamides as Novel Reversible Inhibitors of Histone Lysine Demethylase KDM1A/LSD1: Compound 15
分子名称: 4-methyl-~{N}-[2-[[4-(1-methylpiperidin-4-yl)oxyphenoxy]methyl]phenyl]thieno[3,2-b]pyrrole-5-carboxamide, FLAVIN-ADENINE DINUCLEOTIDE, Lysine-specific histone demethylase 1A, ...
著者Mattevi, A, Ciossani, G.
登録日2016-07-08
公開日2017-02-22
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献Thieno[3,2-b]pyrrole-5-carboxamides as New Reversible Inhibitors of Histone Lysine Demethylase KDM1A/LSD1. Part 2: Structure-Based Drug Design and Structure-Activity Relationship.
J. Med. Chem., 60, 2017
5LT0
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BU of 5lt0 by Molmil
nucleotide-free kinesin-1 motor domain, P212121 crystal form
分子名称: ACETATE ION, Kinesin-like protein, STRONTIUM ION, ...
著者Cao, L, Gigant, B.
登録日2016-09-06
公開日2017-03-01
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献The structural switch of nucleotide-free kinesin.
Sci Rep, 7, 2017
8EOY
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BU of 8eoy by Molmil
Structure of the SARS-CoV-2 main protease in complex with inhibitor MPI37
分子名称: 3C-like proteinase, benzyl {(2S)-1-[2-(3-amino-3-oxopropyl)-2-(chloroacetyl)hydrazinyl]-4-methyl-1-oxopentan-2-yl}carbamate (non-preferred name)
著者Yang, K.S, Liu, W.R.
登録日2022-10-04
公開日2023-10-11
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (2.28 Å)
主引用文献Structure of the SARS-CoV-2 main protease in complex with inhibitors
To Be Published
8P6I
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BU of 8p6i by Molmil
Crystal structure of the 139H2 Fab fragment bound to Muc1 peptide epitope
分子名称: 139H2 HC, 139H2 LC, Mucin-1
著者Beugelink, J.W, Peng, W, Siborova, M, Pronker, M.F, Snijder, J, Janssen, B.J.C.
登録日2023-05-26
公開日2024-04-03
最終更新日2024-04-10
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Reverse-engineering the anti-MUC1 antibody 139H2 by mass spectrometry-based de novo sequencing.
Life Sci Alliance, 7, 2024
8ERH
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BU of 8erh by Molmil
HTLV-1 capsid protein C-terminal domain
分子名称: PHOSPHATE ION, capsid protein p24
著者Yu, R.J, Li, N, Jacques, D.A.
登録日2022-10-11
公開日2023-10-18
実験手法X-RAY DIFFRACTION (1.47 Å)
主引用文献HTLV-1 capsid protein C-terminal domain
To Be Published
6XI1
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BU of 6xi1 by Molmil
Crystal structure of tetra-tandem repeat in extending RTX adhesin from Aeromonas hydrophila
分子名称: CALCIUM ION, CHLORIDE ION, DI(HYDROXYETHYL)ETHER, ...
著者Ye, Q, Vance, T.D.R, Conroy, B, Davies, P.L.
登録日2020-06-19
公開日2020-10-14
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Essential role of calcium in extending RTX adhesins to their target.
J Struct Biol X, 4, 2020
7UAJ
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BU of 7uaj by Molmil
Crystal structure of apo HPV16 E6
分子名称: Maltose/maltodextrin-binding periplasmic protein,Protein E6, ZINC ION, alpha-D-glucopyranose-(1-4)-alpha-D-glucopyranose
著者Shen, Q, Leonard, P.G, Cross, J.B.
登録日2022-03-13
公開日2023-03-15
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (3.25 Å)
主引用文献Disorder-to-order transition of the interdomain linker of HPV E6 upon E6AP binding reshapes p53 binding pocket
To Be Published
8OLH
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BU of 8olh by Molmil
Y345F Variant of Dye Type Peroxidase Aa (DtpAa) from Streptomyces lividans
分子名称: Deferrochelatase, PROTOPORPHYRIN IX CONTAINING FE
著者Lucic, M, Worrall, J.A.R, Hough, M.A.
登録日2023-03-30
公開日2024-04-10
実験手法X-RAY DIFFRACTION (1.23 Å)
主引用文献Y345F Variant of Dye Type Peroxidase Aa (DtpAa) from Streptomyces lividans
To Be Published
5LUH
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BU of 5luh by Molmil
AadA E87Q in complex with ATP, calcium and streptomycin
分子名称: 1,2-ETHANEDIOL, ADENOSINE-5'-TRIPHOSPHATE, CALCIUM ION, ...
著者Stern, A.L, Van der Verren, S.E, Selmer, M.
登録日2016-09-08
公開日2018-01-17
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.73 Å)
主引用文献Structural mechanism of AadA, a dual-specificity aminoglycoside adenylyltransferase fromSalmonella enterica.
J.Biol.Chem., 293, 2018
7UW2
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BU of 7uw2 by Molmil
Crystal structure of human Retinoid X receptor alpha ligand binding domain complex with UAB116 and coactivator peptide GRIP-1
分子名称: (2E,4E,6Z,8E)-8-{3-[(2S)-butan-2-yl]-2-(3-methylbutyl)cyclohex-2-en-1-ylidene}-3,7-dimethylocta-2,4,6-trienoic acid, Nuclear receptor coactivator 2, Retinoic acid receptor RXR-alpha
著者Chattopadhyay, D, Yang, Z, Atigadda, V.
登録日2022-05-02
公開日2023-03-15
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.88 Å)
主引用文献Conformationally Defined Rexinoids for the Prevention of Inflammation and Nonmelanoma Skin Cancers.
J.Med.Chem., 65, 2022
5LUV
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BU of 5luv by Molmil
Short LOV protein W619_1 in apo-state
分子名称: CHLORIDE ION, Putative PAS/PAC sensor protein, SULFATE ION
著者Arinkin, V, Granzin, J, Batra-Safferling, R.
登録日2016-09-12
公開日2017-02-22
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Structure of a LOV protein in apo-state and implications for construction of LOV-based optical tools.
Sci Rep, 7, 2017
8OMC
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BU of 8omc by Molmil
Y345F/F347Y/Y389F Variant of Dye Type Peroxidase Aa (DtpAa) from Streptomyces lividans
分子名称: Deferrochelatase, PROTOPORPHYRIN IX CONTAINING FE
著者Lucic, M, Worrall, J.A.R, Hough, M.A.
登録日2023-03-31
公開日2024-04-10
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Y345F/F347Y/Y389F Variant of Dye Type Peroxidase Aa (DtpAa) from Streptomyces lividans
To Be Published
8EI9
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BU of 8ei9 by Molmil
Crystal structure of beta-catenin and the MDM2 p53-binding domain in complex with H332, a Helicon Polypeptide
分子名称: Catenin beta-1, E3 ubiquitin-protein ligase Mdm2, H332, ...
著者Li, K, Travaline, T.L, Swiecicki, J.-M, Tokareva, O.S, Thomson, T.M, Verdine, G.L, McGee, J.H.
登録日2022-09-14
公開日2023-10-25
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (3.9 Å)
主引用文献Recognition and reprogramming of E3 ubiquitin ligase surfaces by alpha-helical peptides.
Nat Commun, 14, 2023
7UW4
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BU of 7uw4 by Molmil
Crystal structure of human Retinoid X receptor alpha ligand binding domain complex with UAB113 and coactivator peptide GRIP-1
分子名称: (2E,4E,6Z,8E)-3,7-dimethyl-8-[2-(3-methylbutyl)-3-propylcyclohex-2-en-1-ylidene]octa-2,4,6-trienoic acid, Nuclear receptor coactivator 2, Retinoic acid receptor RXR-alpha
著者Chattopadhyay, D, Yang, Z, Atigadda, V.
登録日2022-05-02
公開日2023-03-15
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Conformationally Defined Rexinoids for the Prevention of Inflammation and Nonmelanoma Skin Cancers.
J.Med.Chem., 65, 2022
8EI8
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BU of 8ei8 by Molmil
Crystal structure of the WWP2 HECT domain in complex with H308, a Helicon Polypeptide
分子名称: 1,2-ETHANEDIOL, H308, N,N'-(1,4-phenylene)diacetamide, ...
著者Li, K, Tokareva, O.S, Thomson, T.M, Verdine, G.L, McGee, J.H.
登録日2022-09-14
公開日2023-10-25
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献Recognition and reprogramming of E3 ubiquitin ligase surfaces by alpha-helical peptides.
Nat Commun, 14, 2023
8ONR
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BU of 8onr by Molmil
Crystal structure of human insulin trans-HypB26-DTI analogue
分子名称: Insulin A chain, Insulin B chain, PHENOL, ...
著者Brzozowski, A.M, Zakova, L, Jiracek, J.
登録日2023-04-03
公開日2024-04-10
実験手法X-RAY DIFFRACTION (1.88 Å)
主引用文献Crystal structure of human insulin trans-HypB26-DTI analogue
To Be Published
7ULY
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BU of 7uly by Molmil
MicroED structure of triclinic lysozyme
分子名称: Lysozyme C, NITRATE ION
著者Clabbers, M.T.B, Martynowycz, M.W, Hattne, J, Gonen, T.
登録日2022-04-05
公開日2023-03-15
実験手法ELECTRON CRYSTALLOGRAPHY (0.87 Å)
主引用文献Hydrogens and hydrogen-bond networks in macromolecular MicroED data.
J Struct Biol X, 6, 2022
8ERE
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BU of 8ere by Molmil
HTLV-1 capsid protein N-terminal domain triclinic crystal form
分子名称: capsid protein p24
著者Yu, R.J, Li, N, Jacques, D.A.
登録日2022-10-11
公開日2023-10-18
実験手法X-RAY DIFFRACTION (0.87 Å)
主引用文献HTLV-1 capsid protein N-terminal domain triclinic crystal form
To Be Published
8ONM
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BU of 8onm by Molmil
Crystal structure of D-amino acid aminotransferase from Aminobacterium colombiense point mutant E113A complexed with D-glutamate
分子名称: (~{Z})-2-[[2-methyl-3-oxidanyl-5-(phosphonooxymethyl)pyridin-4-yl]methylamino]pent-2-enedioic acid, 1,2-ETHANEDIOL, 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE, ...
著者Matyuta, I.O, Boyko, K.M, Minyaev, M.E, Shilova, S.A, Bezsudnova, E.Y, Popov, V.O.
登録日2023-04-03
公開日2024-04-10
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Probing of the structural and catalytic roles of the residues in the active site of transaminase from Aminobacterium colombiense
To Be Published
8OKF
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BU of 8okf by Molmil
WD repeat containing protein 5 (WDR5)- PER2 peptide
分子名称: CHLORIDE ION, Glutathione S-transferase class-mu 26 kDa isozyme,WD repeat domain 5, PENTAETHYLENE GLYCOL, ...
著者Wolf, E, Boergel, A.
登録日2023-03-28
公開日2024-04-10
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献A structural competition involving WDR5 times circadian oscillations
To Be Published
8EI1
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BU of 8ei1 by Molmil
Crystal structure of the N-terminal domain of CUL4B in complex with H316, a Helicon Polypeptide
分子名称: Cullin-4B, H316, N,N'-(1,4-phenylene)diacetamide
著者Li, K, Tokareva, O.S, Thomson, T.M, Verdine, G.L, McGee, J.H.
登録日2022-09-14
公開日2023-10-25
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (2.89 Å)
主引用文献Recognition and reprogramming of E3 ubiquitin ligase surfaces by alpha-helical peptides.
Nat Commun, 14, 2023
5LC9
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BU of 5lc9 by Molmil
Structure of Polyphosphate Kinase from Meiothermus ruber Apo-form
分子名称: PHOSPHATE ION, Polyphosphate:AMP phosphotransferase, SULFATE ION
著者Kemper, F, Einsle, O, Gerhardt, S.
登録日2016-06-20
公開日2017-06-21
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.903 Å)
主引用文献Substrate recognition and mechanism revealed by ligand-bound polyphosphate kinase 2 structures.
Proc. Natl. Acad. Sci. U.S.A., 115, 2018
8ERG
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BU of 8erg by Molmil
HTLV-1 capsid protein N-terminal domain hexagonal crystal form
分子名称: SULFATE ION, capsid protein p24
著者Yu, R.J, Li, N, Jacques, D.A.
登録日2022-10-11
公開日2023-10-18
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献HTLV-1 capsid protein N-terminal domain hexagonal crystal form
To Be Published

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件を2024-08-28に公開中

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