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PDB: 27201 件

5FEX
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BU of 5fex by Molmil
HydE from T. maritima in complex with Se-adenosyl-L-selenocysteine (tfinal of the reaction)
分子名称: 3-[(3-CHOLAMIDOPROPYL)DIMETHYLAMMONIO]-1-PROPANESULFONATE, 5'-DEOXYADENOSINE, CHLORIDE ION, ...
著者Rohac, R, Amara, P, Benjdia, A, Martin, L, Ruffie, P, Favier, A, Berteau, O, Mouesca, J.M, Fontecilla-Camps, J.C, Nicolet, Y.
登録日2015-12-17
公開日2016-04-06
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.32 Å)
主引用文献Carbon-sulfur bond-forming reaction catalysed by the radical SAM enzyme HydE.
Nat.Chem., 8, 2016
353D
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BU of 353d by Molmil
CRYSTAL STRUCTURE OF DOMAIN A OF THERMUS FLAVUS 5S RRNA AND THE CONTRIBUTION OF WATER MOLECULES TO ITS STRUCTURE
分子名称: RNA (5'-R(*AP*UP*CP*CP*CP*CP*CP*GP*UP*GP*CP*C)-3'), RNA (5'-R(*GP*GP*UP*GP*CP*GP*GP*GP*GP*GP*AP*U)-3')
著者Betzel, C, Lorenz, S, Furste, J.P, Bald, R, Zhang, M, Schneider, T.R, Wilson, K.S, Erdmann, V.A.
登録日1997-09-29
公開日1997-11-10
最終更新日2023-08-02
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Crystal structure of domain A of Thermus flavus 5S rRNA and the contribution of water molecules to its structure.
FEBS Lett., 351, 1994
5FZ1
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BU of 5fz1 by Molmil
Crystal structure of the catalytic domain of human JARID1B in complex with Maybridge fragment 2,4-dichloro-N-pyridin-3-ylbenzamide (E48115b) (ligand modelled based on PANDDA event map)
分子名称: 1,2-ETHANEDIOL, 2,4-dichloro-N-(pyridin-3-yl)benzamide, DIMETHYL SULFOXIDE, ...
著者Nowak, R, Krojer, T, Johansson, C, Gileadi, C, Kupinska, K, Strain-Damerell, C, Szykowska, A, Burgess-Brown, N.A, Arrowsmith, C.H, Bountra, C, Edwards, A.M, von Delft, F, Brennan, P.E, Oppermann, U.
登録日2016-03-10
公開日2016-05-04
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.39 Å)
主引用文献Crystal Structure of the Catalytic Domain of Human Jarid1B in Complex with E48115B
To be Published
6SGI
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BU of 6sgi by Molmil
Nek2 kinase bound to inhibitor 96
分子名称: 4-[(6-ethyl-7~{H}-purin-2-yl)amino]benzenesulfonamide, CHLORIDE ION, Serine/threonine-protein kinase Nek2
著者Richards, M.W, Mas-Droux, C.P, Bayliss, R.
登録日2019-08-05
公開日2020-06-17
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献2-Arylamino-6-ethynylpurines are cysteine-targeting irreversible inhibitors of Nek2 kinase.
Rsc Med Chem, 11, 2020
5FNC
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BU of 5fnc by Molmil
Dynamic Undocking and the Quasi-Bound State as tools for Drug Design
分子名称: 6-CHLORO-4-N-[(4-METHYLPHENYL)METHYL]PYRIMIDINE- 2,4-DIAMINE, HEAT SHOCK PROTEIN, HSP90-ALPHA, ...
著者Ruiz-Carmona, S, Schmidtke, P, Luque, F.J, Baker, L.M, Matassova, N, Davis, B, Roughley, S, Murray, J, Hubbard, R, Barril, X.
登録日2015-11-13
公開日2016-11-23
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Dynamic undocking and the quasi-bound state as tools for drug discovery.
Nat Chem, 9, 2017
6SUX
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BU of 6sux by Molmil
Terahertz irradiated structure of bovine trypsin (even frames of crystal x37)
分子名称: BENZAMIDINE, CALCIUM ION, Cationic trypsin, ...
著者Ahlberg Gagner, V, Lundholm, I, Jose-Garcia, M.J, Rodilla, H, Friedman, R, Zhaunerchyk, V, Bourenkov, G, Schneider, T, Stake, J, Katona, G.
登録日2019-09-17
公開日2020-01-22
最終更新日2020-01-29
実験手法X-RAY DIFFRACTION (1.16 Å)
主引用文献Clustering of atomic displacement parameters in bovine trypsin reveals a distributed lattice of atoms with shared chemical properties.
Sci Rep, 9, 2019
6SV0
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BU of 6sv0 by Molmil
Non-terahertz irradiated structure of bovine trypsin (odd frames of crystal x37)
分子名称: BENZAMIDINE, CALCIUM ION, Cationic trypsin, ...
著者Ahlberg Gagner, V, Lundholm, I, Garcia-Bonete, M.J, Rodilla, H, Friedman, R, Zhaunerchyk, V, Bourenkov, G, Schneider, T, Stake, J, Katona, G.
登録日2019-09-17
公開日2020-01-22
最終更新日2020-01-29
実験手法X-RAY DIFFRACTION (1.16 Å)
主引用文献Clustering of atomic displacement parameters in bovine trypsin reveals a distributed lattice of atoms with shared chemical properties.
Sci Rep, 9, 2019
5FZR
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BU of 5fzr by Molmil
Designed TPR Protein M4N delta C (CF I)
分子名称: DESIGNED TPR PROTEIN
著者Albrecht, R, Zhu, H, Hartmann, M.D.
登録日2016-03-15
公開日2016-10-12
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.045 Å)
主引用文献Origin of a folded repeat protein from an intrinsically disordered ancestor.
Elife, 5, 2016
5FYV
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BU of 5fyv by Molmil
Crystal structure of the catalytic domain of human JARID1B in complex with oxaloacetate
分子名称: 1,2-ETHANEDIOL, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, CHLORIDE ION, ...
著者Nowak, R, Kopec, J, Johansson, C, Gileadi, C, Kupinska, K, Strain-Damerell, C, Szykowska, A, von Delft, F, Burgess-Brown, N.A, Arrowsmith, C.H, Bountra, C, Edwards, A.M, Oppermann, U.
登録日2016-03-10
公開日2017-03-22
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.87 Å)
主引用文献Crystal Structure of the Catalytic Domain of Human Jarid1B in Complex with Oxaloacetate
To be Published
6SV8
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BU of 6sv8 by Molmil
Terahertz irradiated structure of bovine trypsin (odd frames of crystal x38)
分子名称: BENZAMIDINE, CALCIUM ION, Cationic trypsin, ...
著者Ahlberg Gagner, V, Lundholm, I, Garcia-Bonete, M.J, Rodilla, H, Friedman, R, Zhaunerchyk, V, Bourenkov, G, Schneider, T, Stake, J, Katona, G.
登録日2019-09-18
公開日2020-01-22
最終更新日2020-01-29
実験手法X-RAY DIFFRACTION (1.15 Å)
主引用文献Clustering of atomic displacement parameters in bovine trypsin reveals a distributed lattice of atoms with shared chemical properties.
Sci Rep, 9, 2019
6SVK
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BU of 6svk by Molmil
human Myeloid-derived growth factor (MYDGF)
分子名称: MALONATE ION, Myeloid-derived growth factor
著者Ebenhoch, R, Nar, H.
登録日2019-09-18
公開日2019-11-27
最終更新日2019-12-04
実験手法X-RAY DIFFRACTION (1.604 Å)
主引用文献Crystal structure and receptor-interacting residues of MYDGF - a protein mediating ischemic tissue repair.
Nat Commun, 10, 2019
5FXZ
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BU of 5fxz by Molmil
Crystal structure of JmjC domain of human histone demethylase UTY in complex with citrate
分子名称: 1,2-ETHANEDIOL, CITRATE ANION, HISTONE DEMETHYLASE UTY, ...
著者Nowak, R, Krojer, T, Johansson, C, Gileadi, C, Kupinska, K, von Delft, F, Arrowsmith, C.H, Bountra, C, Edwards, A, Oppermann, U.
登録日2016-03-03
公開日2016-03-16
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.98 Å)
主引用文献Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty in Complex with Citrate
To be Published
5FQ9
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BU of 5fq9 by Molmil
Crystal structure of the OXA10 with 1C
分子名称: (3R)-3-(cyclohexylcarbonylamino)-2-oxidanyl-3,4-dihydro-1,2-benzoxaborinine-8-carboxylic acid, ACETATE ION, BETA-LACTAMASE OXA-10, ...
著者Brem, J, McDonough, M.A, Cain, R, Clifton, I, Fishwick, C.W.G, Schofield, C.J.
登録日2015-12-08
公開日2016-08-17
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Structural basis of metallo-beta-lactamase, serine-beta-lactamase and penicillin-binding protein inhibition by cyclic boronates.
Nat Commun, 7, 2016
5FZS
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BU of 5fzs by Molmil
Designed TPR Protein M4N delta C (CF II)
分子名称: DESIGNED TPR PROTEIN
著者Albrecht, R, Zhu, H, Hartmann, M.D.
登録日2016-03-15
公開日2016-10-12
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.652 Å)
主引用文献Origin of a folded repeat protein from an intrinsically disordered ancestor.
Elife, 5, 2016
6SVD
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BU of 6svd by Molmil
Non-terahertz irradiated structure of bovine trypsin (even frames of crystal x41)
分子名称: BENZAMIDINE, CALCIUM ION, Cationic trypsin, ...
著者Ahlberg Gagner, V, Lundholm, I, Garcia-Bonete, M.J, Rodilla, H, Friedman, R, Zhaunerchyk, V, Bourenkov, G, Schneider, T, Stake, J, Katona, G.
登録日2019-09-18
公開日2020-01-22
最終更新日2020-01-29
実験手法X-RAY DIFFRACTION (1.15 Å)
主引用文献Clustering of atomic displacement parameters in bovine trypsin reveals a distributed lattice of atoms with shared chemical properties.
Sci Rep, 9, 2019
6SVW
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BU of 6svw by Molmil
Reference structure of bovine trypsin (even frames of crystal x33)
分子名称: BENZAMIDINE, CALCIUM ION, Cationic trypsin, ...
著者Ahlberg Gagner, V, Lundholm, I, Garcia-Bonete, M.J, Rodilla, H, Friedman, R, Zhaunerchyk, V, Bourenkov, G, Schneider, T, Stake, J, Katona, G.
登録日2019-09-19
公開日2020-01-22
最終更新日2020-01-29
実験手法X-RAY DIFFRACTION (1.16 Å)
主引用文献Clustering of atomic displacement parameters in bovine trypsin reveals a distributed lattice of atoms with shared chemical properties.
Sci Rep, 9, 2019
6SW0
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BU of 6sw0 by Molmil
Reference structure of bovine trypsin (odd frames of crystal x34)
分子名称: BENZAMIDINE, CALCIUM ION, Cationic trypsin, ...
著者Ahlberg Gagner, V, Lundholm, I, Garcia-Bonete, M.J, Rodilla, H, Friedman, R, Zhaunerchyk, V, Bourenkov, G, Schneider, T, Stake, J, Katona, G.
登録日2019-09-19
公開日2020-01-22
最終更新日2020-01-29
実験手法X-RAY DIFFRACTION (1.15 Å)
主引用文献Clustering of atomic displacement parameters in bovine trypsin reveals a distributed lattice of atoms with shared chemical properties.
Sci Rep, 9, 2019
5FT8
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BU of 5ft8 by Molmil
Crystal structure of the complex between the cysteine desulfurase CsdA and the sulfur-acceptor CsdE in the persulfurated state at 2.50 Angstroem resolution
分子名称: Cysteine desulfurase CsdA, DI(HYDROXYETHYL)ETHER, GLYCEROL, ...
著者Fernandez, F.J, Arda, A, Lopez-Estepa, M, Aranda, J, Penya-Soler, E, Garces, F, Round, A, Campos-Oliva, R, Bruix, M, Coll, M, Tunon, I, Jimenez-Barbero, J, Vega, M.C.
登録日2016-01-11
公開日2016-11-23
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Mechanism of Sulfur Transfer Across Protein-Protein Interfaces: The Cysteine Desulfurase Model System
Acs Catalysis, 6, 2016
5FYI
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BU of 5fyi by Molmil
Crystal structure of human JMJD2A in complex with pyruvate
分子名称: (2-hydroxyethoxy)acetaldehyde, 1,2-ETHANEDIOL, DIMETHYL SULFOXIDE, ...
著者Nowak, R, Kopec, J, Johansson, C, Szykowska, A, von Delft, F, Arrowsmith, C.H, Bountra, C, Edwards, A, Oppermann, U.
登録日2016-03-07
公開日2016-03-16
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.096 Å)
主引用文献Crystal Structure of Human Jmjd2A in Complex with Pyruvate
To be Published
5FY5
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BU of 5fy5 by Molmil
Crystal structure of the catalytic domain of human JARID1B in complex with fumarate
分子名称: 1,2-ETHANEDIOL, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, FUMARIC ACID, ...
著者Nowak, R, Srikannathasan, V, Johansson, C, Gileadi, C, Kupinska, K, Strain-Damerell, C, Szykowska, A, von Delft, F, Burgess-Brown, N.A, Arrowsmith, C.H, Bountra, C, Edwards, A.M, Oppermann, U.
登録日2016-03-04
公開日2017-03-22
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.47 Å)
主引用文献Crystal Structure of the Catalytic Domain of Human Jarid1B in Complex with Fumarate
To be Published
5FYH
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BU of 5fyh by Molmil
Crystal structure of human JMJD2A in complex with fumarate
分子名称: 1,2-ETHANEDIOL, FUMARIC ACID, LYSINE-SPECIFIC DEMETHYLASE 4A, ...
著者Nowak, R, Kopec, J, Johansson, C, Szykowska, A, von Delft, F, Arrowsmith, C.H, Bountra, C, Edwards, A, Oppermann, U.
登録日2016-03-07
公開日2016-03-23
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.348 Å)
主引用文献Crystal Structure of Human Jmjd2A in Complex with Fumarate
To be Published
5FXW
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BU of 5fxw by Molmil
Crystal structure of JmjC domain of human histone demethylase UTY in complex with fumarate
分子名称: 1,2-ETHANEDIOL, FUMARIC ACID, HISTONE DEMETHYLASE UTY, ...
著者Nowak, R, Krojer, T, Johansson, C, Gileadi, C, Kupinska, K, von Delft, F, Arrowsmith, C.H, Bountra, C, Edwards, A, Oppermann, U.
登録日2016-03-03
公開日2016-03-16
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.09 Å)
主引用文献Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty in Complex with Fumarate
To be Published
5FXV
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BU of 5fxv by Molmil
Crystal structure of JmjC domain of human histone demethylase UTY in complex with N05859b
分子名称: 1,2-ETHANEDIOL, 4-CARBOXYPIPERIDINE, HISTONE DEMETHYLASE UTY, ...
著者Nowak, R, Krojer, T, Johansson, C, Gileadi, C, Kupinska, K, Srikannathasan, V, Oerum, S, Pearce, N.M, von Delft, F, Arrowsmith, C.H, Bountra, C, Edwards, A, Oppermann, U.
登録日2016-03-03
公開日2016-03-16
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.91 Å)
主引用文献Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty in Complex with N05859B
To be Published
5FYC
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BU of 5fyc by Molmil
Crystal structure of human JMJD2A in complex with succinate
分子名称: 1,2-ETHANEDIOL, FUMARIC ACID, LYSINE-SPECIFIC DEMETHYLASE 4A, ...
著者Nowak, R, Kopec, J, Johansson, C, Szykowska, A, von Delft, F, Arrowsmith, C.H, Bountra, C, Edwards, A, Oppermann, U.
登録日2016-03-07
公開日2016-03-16
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.261 Å)
主引用文献Crystal Structure of Human Jmjd2A in Complex with Succinate
To be Published
5FY4
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BU of 5fy4 by Molmil
Crystal structure of the catalytic domain of human JARID1B in complex with succinate
分子名称: 1,2-ETHANEDIOL, FUMARIC ACID, LYSINE-SPECIFIC DEMETHYLASE 5B, ...
著者Nowak, R, Srikannathasan, V, Johansson, C, Gileadi, C, Kupinska, K, Strain-Damerell, C, Szykowska, A, von Delft, F, Burgess-Brown, N.A, Arrowsmith, C.H, Bountra, C, Edwards, A.M, Oppermann, U.
登録日2016-03-04
公開日2017-03-22
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Crystal Structure of the Catalytic Domain of Human Jarid1B in Complex with Succinate
To be Published

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件を2024-07-17に公開中

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