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PDB: 89111 件

8DXJ
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BU of 8dxj by Molmil
HIV-1 reverse transcriptase/rilpivirine with bound fragment 1-N-methyl-4-(trifluoromethyl)benzene-1,2-diamine at the NNRTI adjacent site
分子名称: 1,2-ETHANEDIOL, 4-{[4-({4-[(E)-2-cyanoethenyl]-2,6-dimethylphenyl}amino)pyrimidin-2-yl]amino}benzonitrile, DIMETHYL SULFOXIDE, ...
著者Chopra, A, Ruiz, F.X, Bauman, J.D, Arnold, E.
登録日2022-08-02
公開日2023-05-31
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Halo Library, a Tool for Rapid Identification of Ligand Binding Sites on Proteins Using Crystallographic Fragment Screening.
J.Med.Chem., 66, 2023
5G5E
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BU of 5g5e by Molmil
Crystallographic structure of the Tau class glutathione S-transferase MiGSTU from mango Mangifera indica L.
分子名称: ACETATE ION, DI(HYDROXYETHYL)ETHER, TAU CLASS GLUTATHIONE S-TRANSFERASE
著者Valenzuela-Chavira, I, Serrano-Posada, H, Lopez-Zavala, A, Hernandez-Paredes, J, Sotelo-Mundo, R.
登録日2016-05-24
公開日2017-02-01
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Insights Into Ligand Binding to a Glutathione S-Transferase from Mango: Structure, Thermodynamics and Kinetics
Biochimie, 135, 2017
7NO8
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BU of 7no8 by Molmil
Structure of the mature RSV CA lattice: Group I, pentamer-hexamer interface, class 1"6
分子名称: Capsid protein p27, alternate cleaved 1
著者Obr, M, Ricana, C.L, Nikulin, N, Feathers, J.-P.R, Klanschnig, M, Thader, A, Johnson, M.C, Vogt, V.M, Schur, F.K.M, Dick, R.A.
登録日2021-02-25
公開日2021-04-21
最終更新日2024-07-10
実験手法ELECTRON MICROSCOPY (7.9 Å)
主引用文献Structure of the mature Rous sarcoma virus lattice reveals a role for IP6 in the formation of the capsid hexamer.
Nat Commun, 12, 2021
6SHZ
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BU of 6shz by Molmil
p53 cancer mutant Y220C
分子名称: 1,2-ETHANEDIOL, Cellular tumor antigen p53, GLYCEROL, ...
著者Joerger, A.C, Structural Genomics Consortium (SGC)
登録日2019-08-08
公開日2020-02-19
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.24 Å)
主引用文献Targeting Cavity-Creating p53 Cancer Mutations with Small-Molecule Stabilizers: the Y220X Paradigm.
Acs Chem.Biol., 15, 2020
7NOM
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BU of 7nom by Molmil
Structure of the mature RSV CA lattice: Group IV, hexamer-hexamer interface, class 4'Beta
分子名称: Capsid protein p27, alternate cleaved 1
著者Obr, M, Ricana, C.L, Nikulin, N, Feathers, J.-P.R, Klanschnig, M, Thader, A, Johnson, M.C, Vogt, V.M, Schur, F.K.M, Dick, R.A.
登録日2021-02-25
公開日2021-04-21
最終更新日2024-07-10
実験手法ELECTRON MICROSCOPY (6.7 Å)
主引用文献Structure of the mature Rous sarcoma virus lattice reveals a role for IP6 in the formation of the capsid hexamer.
Nat Commun, 12, 2021
8AGP
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BU of 8agp by Molmil
Halogenated product of limonene epoxide turnover by epoxide hydrolase from metagenomic source ch65
分子名称: (1~{S},2~{S},4~{R})-2-chloranyl-1-methyl-4-prop-1-en-2-yl-cyclohexan-1-ol, 1,2-ETHANEDIOL, Alpha/beta epoxide hydrolase, ...
著者Isupov, M.N, De Rose, S.A, Mitchell, D, Littlechild, J.A.
登録日2022-07-20
公開日2023-08-16
実験手法X-RAY DIFFRACTION (1.49 Å)
主引用文献Complexes of epoxide hydrolase from metagenomic source ch65
To Be Published
6I5S
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BU of 6i5s by Molmil
AH, Bottromycin amidohydrolase
分子名称: CHLORIDE ION, GLYCEROL, ZINC ION, ...
著者Koehnke, J, Sikandar, A.
登録日2018-11-14
公開日2019-09-25
実験手法X-RAY DIFFRACTION (1.73 Å)
主引用文献Thiazoline-Specific Amidohydrolase PurAH Is the Gatekeeper of Bottromycin Biosynthesis.
J.Am.Chem.Soc., 141, 2019
7NO1
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BU of 7no1 by Molmil
Structure of the mature RSV CA lattice: T=3 CA icosahedron
分子名称: Capsid protein p27, alternate cleaved 1
著者Obr, M, Ricana, C.L, Nikulin, N, Feathers, J.-P.R, Klanschnig, M, Thader, A, Johnson, M.C, Vogt, V.M, Schur, F.K.M, Dick, R.A.
登録日2021-02-25
公開日2021-04-21
最終更新日2024-07-10
実験手法ELECTRON MICROSCOPY (7.6 Å)
主引用文献Structure of the mature Rous sarcoma virus lattice reveals a role for IP6 in the formation of the capsid hexamer.
Nat Commun, 12, 2021
6SI4
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BU of 6si4 by Molmil
p53 cancer mutant Y220S in complex with small-molecule stabilizer PK9323
分子名称: 1-[9-ethyl-7-(1,3-thiazol-4-yl)carbazol-3-yl]-~{N}-methyl-methanamine, Cellular tumor antigen p53, GLYCEROL, ...
著者Joerger, A.C, Kraemer, A, Knapp, S, Structural Genomics Consortium (SGC)
登録日2019-08-08
公開日2020-02-19
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Targeting Cavity-Creating p53 Cancer Mutations with Small-Molecule Stabilizers: the Y220X Paradigm.
Acs Chem.Biol., 15, 2020
7NOE
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BU of 7noe by Molmil
Structure of the mature RSV CA lattice: Group III, hexamer-hexamer interface, class 3'5
分子名称: Capsid protein p27, alternate cleaved 1
著者Obr, M, Ricana, C.L, Nikulin, N, Feathers, J.-P.R, Klanschnig, M, Thader, A, Johnson, M.C, Vogt, V.M, Schur, F.K.M, Dick, R.A.
登録日2021-02-25
公開日2021-04-21
最終更新日2024-07-10
実験手法ELECTRON MICROSCOPY (7.5 Å)
主引用文献Structure of the mature Rous sarcoma virus lattice reveals a role for IP6 in the formation of the capsid hexamer.
Nat Commun, 12, 2021
5G5T
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BU of 5g5t by Molmil
Structure of the Argonaute protein from Methanocaldcoccus janaschii in complex with guide DNA
分子名称: ARGONAUTE, GUIDE DNA, MAGNESIUM ION, ...
著者Schneider, S, Oellig, C.A, Keegan, R, Grohmann, D, Zander, A, Willkomm, S.
登録日2016-06-03
公開日2017-02-08
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.85 Å)
主引用文献Structural and mechanistic insights into an archaeal DNA-guided Argonaute protein.
Nat Microbiol, 2, 2017
7NO2
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BU of 7no2 by Molmil
Structure of the mature RSV CA lattice: hexamer derived from tubes (C2-symmetric)
分子名称: Capsid protein p27, alternate cleaved 1
著者Obr, M, Ricana, C.L, Nikulin, N, Feathers, J.-P.R, Klanschnig, M, Thader, A, Johnson, M.C, Vogt, V.M, Schur, F.K.M, Dick, R.A.
登録日2021-02-25
公開日2021-04-21
最終更新日2024-07-10
実験手法ELECTRON MICROSCOPY (4.3 Å)
主引用文献Structure of the mature Rous sarcoma virus lattice reveals a role for IP6 in the formation of the capsid hexamer.
Nat Commun, 12, 2021
7AWX
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BU of 7awx by Molmil
Structure of the FKBP51FK1 domain in complex with the macrocyclic SAFit analogue 55
分子名称: Macrocyclic SAFit analogue 55, Peptidyl-prolyl cis-trans isomerase FKBP5
著者Bauder, M, Meyners, C, Purder, P, Merz, S, Voll, A, Heymann, T, Hausch, F.
登録日2020-11-09
公開日2021-03-17
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Structure-Based Design of High-Affinity Macrocyclic FKBP51 Inhibitors.
J.Med.Chem., 64, 2021
7NOD
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BU of 7nod by Molmil
Structure of the mature RSV CA lattice: Group III, hexamer-hexamer interface, class 3'4
分子名称: Capsid protein p27, alternate cleaved 1
著者Obr, M, Ricana, C.L, Nikulin, N, Feathers, J.-P.R, Klanschnig, M, Thader, A, Johnson, M.C, Vogt, V.M, Schur, F.K.M, Dick, R.A.
登録日2021-02-25
公開日2021-04-21
最終更新日2024-07-10
実験手法ELECTRON MICROSCOPY (7.8 Å)
主引用文献Structure of the mature Rous sarcoma virus lattice reveals a role for IP6 in the formation of the capsid hexamer.
Nat Commun, 12, 2021
7NOG
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BU of 7nog by Molmil
Structure of the mature RSV CA lattice: Group III, hexamer-hexamer interface, class 4'5
分子名称: Capsid protein p27, alternate cleaved 1
著者Obr, M, Ricana, C.L, Nikulin, N, Feathers, J.-P.R, Klanschnig, M, Thader, A, Johnson, M.C, Vogt, V.M, Schur, F.K.M, Dick, R.A.
登録日2021-02-25
公開日2021-04-21
最終更新日2024-07-10
実験手法ELECTRON MICROSCOPY (7.8 Å)
主引用文献Structure of the mature Rous sarcoma virus lattice reveals a role for IP6 in the formation of the capsid hexamer.
Nat Commun, 12, 2021
7NO9
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BU of 7no9 by Molmil
Structure of the mature RSV CA lattice: Group I, pentamer-pentamer interface, class 1'1
分子名称: Capsid protein p27, alternate cleaved 1
著者Obr, M, Ricana, C.L, Nikulin, N, Feathers, J.-P.R, Klanschnig, M, Thader, A, Johnson, M.C, Vogt, V.M, Schur, F.K.M, Dick, R.A.
登録日2021-02-25
公開日2021-04-21
最終更新日2024-07-10
実験手法ELECTRON MICROSCOPY (7.6 Å)
主引用文献Structure of the mature Rous sarcoma virus lattice reveals a role for IP6 in the formation of the capsid hexamer.
Nat Commun, 12, 2021
5G5I
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BU of 5g5i by Molmil
S. enterica HisA mutant D10G
分子名称: 1-(5-phosphoribosyl)-5-[(5-phosphoribosylamino)methylideneamino] imidazole-4-carboxamide isomerase, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, PHOSPHATE ION
著者Guo, X, Soderholm, A, Newton, M, Nasvall, J, Andersson, D, Patrick, W, Selmer, M.
登録日2016-05-25
公開日2017-04-19
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.001 Å)
主引用文献Structural and functional innovations in the real-time evolution of new ( beta alpha )8 barrel enzymes.
Proc. Natl. Acad. Sci. U.S.A., 114, 2017
6R6J
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BU of 6r6j by Molmil
Crystal structure of human carbonic anhydrase isozyme II with 2-(benzenesulfonyl)-4-chloro-N-(2-hydroxyethyl)-5-sulfamoyl-benzamide
分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, 4-chloranyl-~{N}-(2-hydroxyethyl)-2-(phenylsulfonyl)-5-sulfamoyl-benzamide, Carbonic anhydrase 2, ...
著者Smirnov, A, Manakova, E, Grazulis, S.
登録日2019-03-27
公開日2020-04-08
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献Halogenated and di-substituted benzenesulfonamides as selective inhibitors of carbonic anhydrase isoforms.
Eur.J.Med.Chem., 185, 2020
7NOO
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BU of 7noo by Molmil
Structure of the mature RSV CA lattice: Group IV, hexamer-hexamer interface, class 5'Alpha
分子名称: Capsid protein p27, alternate cleaved 1
著者Obr, M, Ricana, C.L, Nikulin, N, Feathers, J.-P.R, Klanschnig, M, Thader, A, Johnson, M.C, Vogt, V.M, Schur, F.K.M, Dick, R.A.
登録日2021-02-25
公開日2021-04-21
最終更新日2024-07-10
実験手法ELECTRON MICROSCOPY (7.9 Å)
主引用文献Structure of the mature Rous sarcoma virus lattice reveals a role for IP6 in the formation of the capsid hexamer.
Nat Commun, 12, 2021
7NOB
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BU of 7nob by Molmil
Structure of the mature RSV CA lattice: Group II, hexamer-hexamer interface, class 2'6
分子名称: Capsid protein p27, alternate cleaved 1
著者Obr, M, Ricana, C.L, Nikulin, N, Feathers, J.-P.R, Klanschnig, M, Thader, A, Johnson, M.C, Vogt, V.M, Schur, F.K.M, Dick, R.A.
登録日2021-02-25
公開日2021-04-21
最終更新日2024-07-10
実験手法ELECTRON MICROSCOPY (6.7 Å)
主引用文献Structure of the mature Rous sarcoma virus lattice reveals a role for IP6 in the formation of the capsid hexamer.
Nat Commun, 12, 2021
7NO5
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BU of 7no5 by Molmil
Structure of the mature RSV CA lattice: hexamer with 2 adjacent pentamers (C2 symmetric)
分子名称: Capsid protein p27, alternate cleaved 1
著者Obr, M, Ricana, C.L, Nikulin, N, Feathers, J.-P.R, Klanschnig, M, Thader, A, Johnson, M.C, Vogt, V.M, Schur, F.K.M, Dick, R.A.
登録日2021-02-25
公開日2021-04-21
最終更新日2024-07-10
実験手法ELECTRON MICROSCOPY (7.4 Å)
主引用文献Structure of the mature Rous sarcoma virus lattice reveals a role for IP6 in the formation of the capsid hexamer.
Nat Commun, 12, 2021
6UWX
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BU of 6uwx by Molmil
Cocrystal of BRD4(D1) with a ethyl carbamate thiazepane inhibitor
分子名称: 1,2-ETHANEDIOL, Bromodomain-containing protein 4, ethyl (7S)-7-(thiophen-2-yl)-1,4-thiazepane-4-carboxylate
著者Johnson, J.A, Pomerantz, W.C.K.
登録日2019-11-05
公開日2020-01-01
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.307 Å)
主引用文献Evaluating the Advantages of Using 3D-Enriched Fragments for Targeting BET Bromodomains.
Acs Med.Chem.Lett., 10, 2019
7NOK
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BU of 7nok by Molmil
Structure of the mature RSV CA lattice: Group IV, hexamer-hexamer interface, class 3'Gamma
分子名称: Capsid protein p27, alternate cleaved 1
著者Obr, M, Ricana, C.L, Nikulin, N, Feathers, J.-P.R, Klanschnig, M, Thader, A, Johnson, M.C, Vogt, V.M, Schur, F.K.M, Dick, R.A.
登録日2021-02-25
公開日2021-04-21
最終更新日2024-07-10
実験手法ELECTRON MICROSCOPY (9.1 Å)
主引用文献Structure of the mature Rous sarcoma virus lattice reveals a role for IP6 in the formation of the capsid hexamer.
Nat Commun, 12, 2021
5G5F
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BU of 5g5f by Molmil
Crystallographic structure of the Tau class glutathione S-transferase MiGSTU in complex with reduced glutathione.
分子名称: DI(HYDROXYETHYL)ETHER, GLUTATHIONE, TAU CLASS GLUTATHIONE S-TRANSFERASE
著者Valenzuela-Chavira, I, Serrano-Posada, H, Lopez-Zavala, A, Hernandez-Paredes, J, Sotelo-Mundo, R.
登録日2016-05-24
公開日2017-02-01
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Insights Into Ligand Binding to a Glutathione S-Transferase from Mango: Structure, Thermodynamics and Kinetics
Biochimie, 135, 2017
7NO7
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BU of 7no7 by Molmil
Structure of the mature RSV CA lattice: Group I, pentamer-hexamer interface, class 1"2
分子名称: Capsid protein p27, alternate cleaved 1
著者Obr, M, Ricana, C.L, Nikulin, N, Feathers, J.-P.R, Klanschnig, M, Thader, A, Johnson, M.C, Vogt, V.M, Schur, F.K.M, Dick, R.A.
登録日2021-02-25
公開日2021-04-21
最終更新日2024-07-10
実験手法ELECTRON MICROSCOPY (7.5 Å)
主引用文献Structure of the mature Rous sarcoma virus lattice reveals a role for IP6 in the formation of the capsid hexamer.
Nat Commun, 12, 2021

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件を2024-09-11に公開中

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