4G35
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![BU of 4g35 by Molmil](/molmil-images/mine/4g35) | Mcl-1 in complex with a biphenyl cross-linked Noxa peptide. | 分子名称: | 4,4'-bis(bromomethyl)biphenyl, Induced myeloid leukemia cell differentiation protein Mcl-1 homolog, Noxa BH3 peptide (cysteine-mediated cross-linked) | 著者 | Drake, E, Edwardraja, S, Lin, Q, Gulick, A.M. | 登録日 | 2012-07-13 | 公開日 | 2012-12-05 | 最終更新日 | 2013-06-26 | 実験手法 | X-RAY DIFFRACTION (2 Å) | 主引用文献 | Rational design of proteolytically stable, cell-permeable peptide-based selective Mcl-1 inhibitors. J.Am.Chem.Soc., 134, 2012
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3L94
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![BU of 3l94 by Molmil](/molmil-images/mine/3l94) | Structure of PvdQ covalently acylated with myristate | 分子名称: | 1,2-ETHANEDIOL, Acyl-homoserine lactone acylase pvdQ subunit alpha, Acyl-homoserine lactone acylase pvdQ subunit beta, ... | 著者 | Drake, E.J, Gulick, A.M. | 登録日 | 2010-01-04 | 公開日 | 2011-01-26 | 最終更新日 | 2013-04-17 | 実験手法 | X-RAY DIFFRACTION (1.95 Å) | 主引用文献 | Structural characterization and high-throughput screening of inhibitors of PvdQ, an NTN hydrolase involved in pyoverdine synthesis. Acs Chem.Biol., 6, 2011
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2FQ1
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![BU of 2fq1 by Molmil](/molmil-images/mine/2fq1) | Crystal structure of the two-domain non-ribosomal peptide synthetase EntB containing isochorismate lyase and aryl-carrier protein domains | 分子名称: | 1,2-ETHANEDIOL, CHLORIDE ION, Isochorismatase, ... | 著者 | Drake, E.J, Nicolai, D.A, Gulick, A.M. | 登録日 | 2006-01-17 | 公開日 | 2006-05-02 | 最終更新日 | 2023-08-30 | 実験手法 | X-RAY DIFFRACTION (2.3 Å) | 主引用文献 | Structure of the EntB multidomain nonribosomal peptide synthetase and functional analysis of its interaction with the EntE adenylation domain. Chem.Biol., 13, 2006
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3L91
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![BU of 3l91 by Molmil](/molmil-images/mine/3l91) | Structure of Pseudomonas aerugionsa PvdQ bound to octanoate | 分子名称: | 1,2-ETHANEDIOL, Acyl-homoserine lactone acylase pvdQ subunit alpha, Acyl-homoserine lactone acylase pvdQ subunit beta, ... | 著者 | Drake, E.J, Gulick, A.M. | 登録日 | 2010-01-04 | 公開日 | 2011-01-19 | 最終更新日 | 2023-09-06 | 実験手法 | X-RAY DIFFRACTION (1.66 Å) | 主引用文献 | Structural characterization and high-throughput screening of inhibitors of PvdQ, an NTN hydrolase involved in pyoverdine synthesis. Acs Chem.Biol., 6, 2011
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4ZXI
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![BU of 4zxi by Molmil](/molmil-images/mine/4zxi) | Crystal Structure of holo-AB3403 a four domain nonribosomal peptide synthetase bound to AMP and Glycine | 分子名称: | 1,2-DIMYRISTOYL-SN-GLYCERO-3-PHOSPHATE, 4'-PHOSPHOPANTETHEINE, ADENOSINE MONOPHOSPHATE, ... | 著者 | Drake, E.J, Miller, B.R, Allen, C.L, Gulick, A.M. | 登録日 | 2015-05-20 | 公開日 | 2015-12-30 | 最終更新日 | 2019-12-25 | 実験手法 | X-RAY DIFFRACTION (2.9 Å) | 主引用文献 | Structures of two distinct conformations of holo-non-ribosomal peptide synthetases. Nature, 529, 2016
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4ZXH
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![BU of 4zxh by Molmil](/molmil-images/mine/4zxh) | Crystal Structure of holo-AB3403 a four domain nonribosomal peptide synthetase from Acinetobacter Baumanii | 分子名称: | 1,2-DIMYRISTOYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 4'-PHOSPHOPANTETHEINE, ABBFA_003403, ... | 著者 | Drake, E.J, Miller, B.R, Allen, C.L, Gulick, A.M. | 登録日 | 2015-05-20 | 公開日 | 2015-12-30 | 最終更新日 | 2019-12-25 | 実験手法 | X-RAY DIFFRACTION (2.7 Å) | 主引用文献 | Structures of two distinct conformations of holo-non-ribosomal peptide synthetases. Nature, 529, 2016
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3O84
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![BU of 3o84 by Molmil](/molmil-images/mine/3o84) | Structure of BasE N-terminal domain from Acinetobacter baumannii bound to 6-phenyl-1-(pyridin-4-ylmethyl)-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid. | 分子名称: | (4R)-2-METHYLPENTANE-2,4-DIOL, (4S)-2-METHYL-2,4-PENTANEDIOL, 6-phenyl-1-(pyridin-4-ylmethyl)-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid, ... | 著者 | Drake, E.J, Duckworth, B.P, Neres, J, Aldrich, C.C, Gulick, A.M. | 登録日 | 2010-08-02 | 公開日 | 2010-10-06 | 最終更新日 | 2023-09-06 | 実験手法 | X-RAY DIFFRACTION (2.1 Å) | 主引用文献 | Biochemical and structural characterization of bisubstrate inhibitors of BasE, the self-standing nonribosomal peptide synthetase adenylate-forming enzyme of acinetobactin synthesis. Biochemistry, 49, 2010
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3O82
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![BU of 3o82 by Molmil](/molmil-images/mine/3o82) | Structure of BasE N-terminal domain from Acinetobacter baumannii bound to 5'-O-[N-(2,3-dihydroxybenzoyl)sulfamoyl] adenosine | 分子名称: | 5'-O-{[(2,3-dihydroxyphenyl)carbonyl]sulfamoyl}adenosine, CALCIUM ION, Peptide arylation enzyme | 著者 | Drake, E.J, Duckworth, B.P, Neres, J, Aldrich, C.C, Gulick, A.M. | 登録日 | 2010-08-02 | 公開日 | 2010-10-06 | 最終更新日 | 2023-09-06 | 実験手法 | X-RAY DIFFRACTION (2.7 Å) | 主引用文献 | Biochemical and structural characterization of bisubstrate inhibitors of BasE, the self-standing nonribosomal peptide synthetase adenylate-forming enzyme of acinetobactin synthesis. Biochemistry, 49, 2010
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3O83
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![BU of 3o83 by Molmil](/molmil-images/mine/3o83) | Structure of BasE N-terminal domain from Acinetobacter baumannii bound to 2-(4-n-dodecyl-1,2,3-triazol-1-yl)-5'-O-[N-(2-hydroxybenzoyl)sulfamoyl]adenosine | 分子名称: | (4R)-2-METHYLPENTANE-2,4-DIOL, (4S)-2-METHYL-2,4-PENTANEDIOL, 2-(4-dodecyl-1H-1,2,3-triazol-1-yl)-5'-O-{[(2-hydroxyphenyl)carbonyl]sulfamoyl}adenosine, ... | 著者 | Drake, E.J, Duckworth, B.P, Neres, J, Aldrich, C.C, Gulick, A.M. | 登録日 | 2010-08-02 | 公開日 | 2010-10-06 | 最終更新日 | 2023-09-06 | 実験手法 | X-RAY DIFFRACTION (1.9 Å) | 主引用文献 | Biochemical and structural characterization of bisubstrate inhibitors of BasE, the self-standing nonribosomal peptide synthetase adenylate-forming enzyme of acinetobactin synthesis. Biochemistry, 49, 2010
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4K2F
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![BU of 4k2f by Molmil](/molmil-images/mine/4k2f) | Structure of Pseudomonas aeruginosa PvdQ bound to BRD-A08522488 | 分子名称: | (2S)-(4-chlorophenyl)(6-chloropyridin-2-yl)ethanenitrile, 1,2-ETHANEDIOL, Acyl-homoserine lactone acylase PvdQ | 著者 | Drake, E.J, Wurst, J.M, Theriault, J.R, Munoz, B, Gulick, A.M. | 登録日 | 2013-04-09 | 公開日 | 2014-06-18 | 最終更新日 | 2023-09-20 | 実験手法 | X-RAY DIFFRACTION (1.99 Å) | 主引用文献 | Identification of Inhibitors of PvdQ, an Enzyme Involved in the Synthesis of the Siderophore Pyoverdine. Acs Chem.Biol., 9, 2014
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4K2G
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![BU of 4k2g by Molmil](/molmil-images/mine/4k2g) | Structure of Pseudomonas aeruginosa PvdQ bound to BRD-A33442372 | 分子名称: | (2S)-(4-fluorophenyl)[6-(trifluoromethyl)pyridin-2-yl]ethanenitrile, 1,2-ETHANEDIOL, Acyl-homoserine lactone acylase PvdQ | 著者 | Drake, E.J, Wurst, J.M, Theriault, J.R, Munoz, B, Gulick, A.M. | 登録日 | 2013-04-09 | 公開日 | 2014-06-18 | 最終更新日 | 2023-09-20 | 実験手法 | X-RAY DIFFRACTION (2.3 Å) | 主引用文献 | Identification of Inhibitors of PvdQ, an Enzyme Involved in the Synthesis of the Siderophore Pyoverdine. Acs Chem.Biol., 9, 2014
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5I3F
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![BU of 5i3f by Molmil](/molmil-images/mine/5i3f) | Structure-Function Studies on Role of Hydrophobic Clamping of a Basic Glutamate in Catalysis by Triosephosphate Isomerase | 分子名称: | Triosephosphate isomerase, glycosomal | 著者 | Drake, E.J, Gulick, A.M, Richard, J.P, Zhai, X, Kim, K, Reinhardt, C.J. | 登録日 | 2016-02-10 | 公開日 | 2016-05-18 | 最終更新日 | 2023-09-27 | 実験手法 | X-RAY DIFFRACTION (1.72 Å) | 主引用文献 | Structure-Function Studies of Hydrophobic Residues That Clamp a Basic Glutamate Side Chain during Catalysis by Triosephosphate Isomerase. Biochemistry, 55, 2016
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5I3H
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![BU of 5i3h by Molmil](/molmil-images/mine/5i3h) | Structure-Function Studies on Role of Hydrophobic Clamping of a Basic Glutamate in Catalysis by Triosephosphate Isomerase | 分子名称: | 2-PHOSPHOGLYCOLIC ACID, POTASSIUM ION, Triosephosphate isomerase, ... | 著者 | Drake, E.J, Gulick, A.M, Richard, J.P, Zhai, X, Kim, K, Reinhardt, C.J. | 登録日 | 2016-02-10 | 公開日 | 2016-05-18 | 最終更新日 | 2023-09-27 | 実験手法 | X-RAY DIFFRACTION (2.25 Å) | 主引用文献 | Structure-Function Studies of Hydrophobic Residues That Clamp a Basic Glutamate Side Chain during Catalysis by Triosephosphate Isomerase. Biochemistry, 55, 2016
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5I3J
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![BU of 5i3j by Molmil](/molmil-images/mine/5i3j) | Structure-Function Studies on Role of Hydrophobic Clamping of a Basic Glutamate in Catalysis by Triosephosphate Isomerase | 分子名称: | SODIUM ION, Triosephosphate isomerase, glycosomal | 著者 | Drake, E.J, Gulick, A.M, Richard, J.P, Zhai, X, Kim, K, Reinhardt, C.J. | 登録日 | 2016-02-10 | 公開日 | 2016-05-18 | 最終更新日 | 2023-09-27 | 実験手法 | X-RAY DIFFRACTION (1.8 Å) | 主引用文献 | Structure-Function Studies of Hydrophobic Residues That Clamp a Basic Glutamate Side Chain during Catalysis by Triosephosphate Isomerase. Biochemistry, 55, 2016
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5I3G
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![BU of 5i3g by Molmil](/molmil-images/mine/5i3g) | Structure-Function Studies on Role of Hydrophobic Clamping of a Basic Glutamate in Catalysis by Triosephosphate Isomerase | 分子名称: | Triosephosphate isomerase, glycosomal | 著者 | Drake, E.J, Gulick, A.M, Richard, J.P, Zhai, X, Kim, K, Reinhardt, C.J. | 登録日 | 2016-02-10 | 公開日 | 2016-05-18 | 最終更新日 | 2023-09-27 | 実験手法 | X-RAY DIFFRACTION (1.96 Å) | 主引用文献 | Structure-Function Studies of Hydrophobic Residues That Clamp a Basic Glutamate Side Chain during Catalysis by Triosephosphate Isomerase. Biochemistry, 55, 2016
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5I3I
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![BU of 5i3i by Molmil](/molmil-images/mine/5i3i) | Structure-Function Studies on Role of Hydrophobic Clamping of a Basic Glutamate in Catalysis by Triosephosphate Isomerase | 分子名称: | 2-PHOSPHOGLYCOLIC ACID, Triosephosphate isomerase, glycosomal | 著者 | Drake, E.J, Gulick, A.M, Richard, J.P, Zhai, X, Kim, K, Reinhardt, C.J. | 登録日 | 2016-02-10 | 公開日 | 2016-05-18 | 最終更新日 | 2023-09-27 | 実験手法 | X-RAY DIFFRACTION (2.2 Å) | 主引用文献 | Structure-Function Studies of Hydrophobic Residues That Clamp a Basic Glutamate Side Chain during Catalysis by Triosephosphate Isomerase. Biochemistry, 55, 2016
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5I3K
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![BU of 5i3k by Molmil](/molmil-images/mine/5i3k) | Structure-Function Studies on Role of Hydrophobic Clamping of a Basic Glutamate in Catalysis by Triosephosphate Isomerase | 分子名称: | 2-PHOSPHOGLYCOLIC ACID, SODIUM ION, Triosephosphate isomerase, ... | 著者 | Drake, E.J, Gulick, A.M, Richard, J.P, Zhai, X, Kim, K, Reinhardt, C.J. | 登録日 | 2016-02-10 | 公開日 | 2016-05-18 | 最終更新日 | 2023-09-27 | 実験手法 | X-RAY DIFFRACTION (2.209 Å) | 主引用文献 | Structure-Function Studies of Hydrophobic Residues That Clamp a Basic Glutamate Side Chain during Catalysis by Triosephosphate Isomerase. Biochemistry, 55, 2016
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5I90
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![BU of 5i90 by Molmil](/molmil-images/mine/5i90) | |
5JM7
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![BU of 5jm7 by Molmil](/molmil-images/mine/5jm7) | |
5T3D
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![BU of 5t3d by Molmil](/molmil-images/mine/5t3d) | Crystal structure of holo-EntF a nonribosomal peptide synthetase in the thioester-forming conformation | 分子名称: | 5'-({[(2R,3S)-3-amino-4-hydroxy-2-{[2-({N-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl]sulfanyl}butyl]sulfonyl}amino)-5'-deoxyadenosine, Enterobactin synthase component F | 著者 | Miller, B.R, Drake, E.J, Sundlov, J.A, Gulick, A.M. | 登録日 | 2016-08-25 | 公開日 | 2016-09-21 | 最終更新日 | 2019-12-25 | 実験手法 | X-RAY DIFFRACTION (2.8 Å) | 主引用文献 | Structures of two distinct conformations of holo-non-ribosomal peptide synthetases. Nature, 529, 2016
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2PST
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![BU of 2pst by Molmil](/molmil-images/mine/2pst) | |
3E59
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![BU of 3e59 by Molmil](/molmil-images/mine/3e59) | |
3EAT
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![BU of 3eat by Molmil](/molmil-images/mine/3eat) | |
4JNJ
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![BU of 4jnj by Molmil](/molmil-images/mine/4jnj) | Structure based engineering of streptavidin monomer with a reduced biotin dissociation rate | 分子名称: | BIOTIN, Streptavidin/Rhizavidin Hybrid, ZINC ION | 著者 | DeMonte, D, Drake, E.J, Hong Lim, K, Gulick, A.M, Park, S. | 登録日 | 2013-03-15 | 公開日 | 2013-05-29 | 最終更新日 | 2013-11-13 | 実験手法 | X-RAY DIFFRACTION (1.902 Å) | 主引用文献 | Structure-based engineering of streptavidin monomer with a reduced biotin dissociation rate. Proteins, 81, 2013
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3U16
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![BU of 3u16 by Molmil](/molmil-images/mine/3u16) | Structure of BasE N-terminal domain from Acinetobacter baumannii bound to 6-(p-benzyloxy)phenyl-1-(pyridin-4-ylmethyl)-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid. | 分子名称: | (4R)-2-METHYLPENTANE-2,4-DIOL, (4S)-2-METHYL-2,4-PENTANEDIOL, 6-[4-(benzyloxy)phenyl]-1-(pyridin-4-ylmethyl)-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid, ... | 著者 | Gulick, A.M, Drake, E.J, Aldrich, C.C, Neres, J. | 登録日 | 2011-09-29 | 公開日 | 2012-10-03 | 最終更新日 | 2023-09-13 | 実験手法 | X-RAY DIFFRACTION (2.1 Å) | 主引用文献 | Non-nucleoside inhibitors of BasE, an adenylating enzyme in the siderophore biosynthetic pathway of the opportunistic pathogen Acinetobacter baumannii. J.Med.Chem., 56, 2013
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