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1JMK
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BU of 1jmk by Molmil
Structural Basis for the Cyclization of the Lipopeptide Antibiotic Surfactin by the Thioesterase Domain SrfTE
分子名称: SULFATE ION, Surfactin Synthetase
著者Bruner, S.D, Weber, T, Kohli, R.M, Schwarzer, D, Marahiel, M.A, Walsh, C.T, Stubbs, M.T.
登録日2001-07-18
公開日2002-03-27
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.71 Å)
主引用文献Structural basis for the cyclization of the lipopeptide antibiotic surfactin by the thioesterase domain SrfTE.
Structure, 10, 2002
1IIR
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BU of 1iir by Molmil
Crystal Structure of UDP-glucosyltransferase GtfB
分子名称: MAGNESIUM ION, SULFATE ION, glycosyltransferase GtfB
著者Mulichak, A.M, Losey, H.C, Walsh, C.T, Garavito, R.M.
登録日2001-04-24
公開日2001-07-18
最終更新日2024-02-07
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Structure of the UDP-glucosyltransferase GtfB that modifies the heptapeptide aglycone in the biosynthesis of vancomycin group antibiotics.
Structure, 9, 2001
2ROQ
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BU of 2roq by Molmil
Solution Structure of the thiolation-thioesterase di-domain of enterobactin synthetase component F
分子名称: Enterobactin synthetase component F
著者Frueh, D.P, Arthanari, H, Koglin, A, Vosburg, D.A, Bennett, A.E, Walsh, C.T, Wagner, G.
登録日2008-04-05
公開日2008-08-12
最終更新日2024-05-29
実験手法SOLUTION NMR
主引用文献Dynamic thiolation-thioesterase structure of a non-ribosomal peptide synthetase
Nature, 454, 2008
2RON
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BU of 2ron by Molmil
The external thioesterase of the Surfactin-Synthetase
分子名称: Surfactin synthetase thioesterase subunit
著者Koglin, A, Lohr, F, Bernhard, F, Rogov, V.V, Frueh, D.P, Strieter, E.R, Mofid, M.R, Guentert, P, Wagner, G, Walsh, C.T, Marahiel, M.A, Doetsch, V.
登録日2008-04-04
公開日2008-08-12
最終更新日2024-05-01
実験手法SOLUTION NMR
主引用文献Structural basis for the selectivity of the external thioesterase of the surfactin synthetase
Nature, 454, 2008
2GZR
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BU of 2gzr by Molmil
Enterobactin and Salmochelin Hydrolase IroE
分子名称: IroE protein
著者Larsen, N.A, Walsh, C.T.
登録日2006-05-11
公開日2006-09-05
最終更新日2024-11-13
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Structural Characterization of Enterobactin Hydrolase IroE.
Biochemistry, 45, 2006
2GZS
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BU of 2gzs by Molmil
Enterobactin Hydolase IroE Complex with DFP
分子名称: DIISOPROPYL PHOSPHONATE, IroE protein
著者Larsen, N.A, Walsh, C.T.
登録日2006-05-12
公開日2006-09-05
最終更新日2024-10-09
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Structural Characterization of Enterobactin Hydrolase IroE.
Biochemistry, 45, 2006
1L5A
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BU of 1l5a by Molmil
Crystal Structure of VibH, an NRPS Condensation Enzyme
分子名称: amide synthase
著者Keating, T.A, Marshall, C.G, Walsh, C.T, Keating, A.E.
登録日2002-03-06
公開日2002-06-26
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (2.55 Å)
主引用文献The structure of VibH represents nonribosomal peptide synthetase condensation, cyclization and epimerization domains.
Nat.Struct.Biol., 9, 2002
2ISK
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BU of 2isk by Molmil
BluB bound to flavin anion (charge transfer complex)
分子名称: 1-DEOXY-1-(7,8-DIMETHYL-2,4-DIOXO-3,4-DIHYDRO-2H-BENZO[G]PTERIDIN-1-ID-10(5H)-YL)-5-O-PHOSPHONATO-D-RIBITOL, BluB
著者Larsen, N.A, Taga, M.E, Howard-Jones, A.R, Walsh, C.T, Walker, G.C.
登録日2006-10-17
公開日2007-03-27
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献BluB cannibalizes flavin to form the lower ligand of vitamin B12.
Nature, 446, 2007
2ISL
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BluB bound to reduced flavin (FMNH2) and molecular oxygen. (clear crystal form)
分子名称: 1-DEOXY-1-(7,8-DIMETHYL-2,4-DIOXO-3,4-DIHYDRO-2H-BENZO[G]PTERIDIN-1-ID-10(5H)-YL)-5-O-PHOSPHONATO-D-RIBITOL, BluB, OXYGEN MOLECULE
著者Larsen, N.A, Taga, M.E, Howard-Jones, A.R, Walsh, C.T, Walker, G.C.
登録日2006-10-17
公開日2007-03-27
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献BluB cannibalizes flavin to form the lower ligand of vitamin B12.
Nature, 446, 2007
2K2Q
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BU of 2k2q by Molmil
complex structure of the external thioesterase of the Surfactin-synthetase with a carrier domain
分子名称: Surfactin synthetase thioesterase subunit, Tyrocidine synthetase 3 (Tyrocidine synthetase III)
著者Koglin, A, Lohr, F, Bernhard, F, Rogov, V.V, Frueh, D.P, Strieter, E.R, Mofid, M.R, Guntert, P, Wagner, G, Walsh, C.T, Marahiel, M.A, Dotsch, V.
登録日2008-04-10
公開日2008-12-09
最終更新日2024-05-01
実験手法SOLUTION NMR
主引用文献Structural basis for the selectivity of the external thioesterase of the surfactin synthetase.
Nature, 454, 2008
2MLP
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BU of 2mlp by Molmil
MICROCIN LEADER PEPTIDE FROM E. COLI, NMR, 25 STRUCTURES
分子名称: MCBA PROPEPTIDE
著者Kim, S, Sinha Roy, R, Walsh, C.T, Baleja, J.D.
登録日1998-01-21
公開日1998-07-22
最終更新日2024-10-23
実験手法SOLUTION NMR
主引用文献Role of the microcin B17 propeptide in substrate recognition: solution structure and mutational analysis of McbA1-26.
Chem.Biol., 5, 1998
2LIW
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BU of 2liw by Molmil
NMR structure of HMG-ACPI domain from CurA module from Lyngbya majuscula
分子名称: 3-HYDROXY-3-METHYL-GLUTARIC ACID, 4'-PHOSPHOPANTETHEINE, CurA
著者Busche, A.E, Gottstein, D, Hein, C, Ripin, N, Pader, I, Tufar, P, Eisman, E.B, Gu, L, Walsh, C.T, Loehr, F, Sherman, D.H, Guntert, P, Dotsch, V.
登録日2011-09-01
公開日2011-12-21
最終更新日2025-03-26
実験手法SOLUTION NMR
主引用文献Characterization of Molecular Interactions between ACP and Halogenase Domains in the Curacin A Polyketide Synthase.
Acs Chem.Biol., 7, 2012
2LIU
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BU of 2liu by Molmil
NMR structure of holo-ACPI domain from CurA module from Lyngbya majuscula
分子名称: CurA
著者Busche, A.E, Gottstein, D, Hein, C, Ripin, N, Pader, I, Tufar, P, Eisman, E.B, Gu, L, Walsh, C.T, Loehr, F, Sherman, D.H, Guntert, P, Dotsch, V.
登録日2011-09-01
公開日2011-12-14
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Characterization of Molecular Interactions between ACP and Halogenase Domains in the Curacin A Polyketide Synthase.
Acs Chem.Biol., 7, 2012
5T81
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BU of 5t81 by Molmil
Rhombohedral crystal form of the EpoB NRPS cyclization-docking bidomain from Sorangium cellulosum
分子名称: EpoB, GLYCEROL
著者Dowling, D.P, Kung, Y, Croft, A.K, Taghizadeh, K, Kelly, W.L, Walsh, C.T, Drennan, C.L.
登録日2016-09-06
公開日2016-11-09
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (2.604 Å)
主引用文献Structural elements of an NRPS cyclization domain and its intermodule docking domain.
Proc.Natl.Acad.Sci.USA, 113, 2016
5T7Z
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BU of 5t7z by Molmil
Monoclinic crystal form of the EpoB NRPS cyclization-docking bidomain from Sorangium cellulosum
分子名称: EpoB
著者Dowling, D.P, Kung, Y, Croft, A.K, Taghizadeh, K, Kelly, W.L, Walsh, C.T, Drennan, C.L.
登録日2016-09-06
公開日2016-11-09
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2.03 Å)
主引用文献Structural elements of an NRPS cyclization domain and its intermodule docking domain.
Proc.Natl.Acad.Sci.USA, 113, 2016
1IOW
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BU of 1iow by Molmil
COMPLEX OF Y216F D-ALA:D-ALA LIGASE WITH ADP AND A PHOSPHORYL PHOSPHINATE
分子名称: 1(S)-AMINOETHYL-(2-CARBOXYPROPYL)PHOSPHORYL-PHOSPHINIC ACID, ADENOSINE-5'-DIPHOSPHATE, D-ALA:D-ALA LIGASE, ...
著者Knox, J.R, Moews, P.C, Fan, C.
登録日1996-09-20
公開日1997-02-12
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献D-alanine:D-alanine ligase: phosphonate and phosphinate intermediates with wild type and the Y216F mutant.
Biochemistry, 36, 1997
1IOV
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BU of 1iov by Molmil
COMPLEX OF D-ALA:D-ALA LIGASE WITH ADP AND A PHOSPHORYL PHOSPHONATE
分子名称: 2-[(1-AMINO-ETHYL)-PHOSPHATE-PHOSPHINOYLOXY]-BUTYRIC ACID, ADENOSINE-5'-DIPHOSPHATE, D-ALA:D-ALA LIGASE, ...
著者Knox, J.R, Moews, P.C, Fan, C.
登録日1996-09-20
公開日1997-02-12
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献D-alanine:D-alanine ligase: phosphonate and phosphinate intermediates with wild type and the Y216F mutant.
Biochemistry, 36, 1997
1OI6
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BU of 1oi6 by Molmil
Structure determination of the TMP-complex of EvaD
分子名称: GLYCEROL, PCZA361.16, THYMIDINE-5'-PHOSPHATE
著者Merkel, A.B, Naismith, J.H.
登録日2003-06-09
公開日2004-06-03
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献The Position of a Key Tyrosine in Dtdp-4-Keto-6-Deoxy-D-Glucose-5-Epimerase (Evad) Alters the Substrate Profile for This Rmlc-Like Enzyme
J.Biol.Chem., 279, 2004
3EPT
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BU of 3ept by Molmil
Structure of the rebeccamycin biosynthetic enzyme RebC with reduced flavin
分子名称: DIHYDROFLAVINE-ADENINE DINUCLEOTIDE, RebC, SODIUM ION
著者Ryan, K.S, Drennan, C.L.
登録日2008-09-30
公開日2008-12-09
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (2.97 Å)
主引用文献The FAD cofactor of RebC shifts to an IN conformation upon flavin reduction
Biochemistry, 47, 2008
1A2N
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BU of 1a2n by Molmil
STRUCTURE OF THE C115A MUTANT OF MURA COMPLEXED WITH THE FLUORINATED ANALOG OF THE REACTION TETRAHEDRAL INTERMEDIATE
分子名称: UDP-N-ACETYLGLUCOSAMINE ENOLPYRUVYL TRANSFERASE, URIDINE-DIPHOSPHATE-2(N-ACETYLGLUCOSAMINYL-3-FLUORO-2-PHOSPHONOOXY)PROPIONIC ACID
著者Skarzynski, T.
登録日1998-01-06
公開日1998-04-29
最終更新日2024-05-22
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Stereochemical course of enzymatic enolpyruvyl transfer and catalytic conformation of the active site revealed by the crystal structure of the fluorinated analogue of the reaction tetrahedral intermediate bound to the active site of the C115A mutant of MurA
Biochemistry, 37, 1998
3BMZ
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BU of 3bmz by Molmil
Violacein biosynthetic enzyme VioE
分子名称: Putative uncharacterized protein, TETRAETHYLENE GLYCOL, TRIETHYLENE GLYCOL
著者Ryan, K.S, Drennan, C.L.
登録日2007-12-13
公開日2008-01-01
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (1.21 Å)
主引用文献The Violacein Biosynthetic Enzyme VioE Shares a Fold with Lipoprotein Transporter Proteins
J.Biol.Chem., 283, 2008
3GJA
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BU of 3gja by Molmil
CytC3
分子名称: ACETATE ION, CytC3
著者Wong, C, Drennan, C.L.
登録日2009-03-08
公開日2009-04-14
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Structural analysis of an open active site conformation of nonheme iron halogenase CytC3
J.Am.Chem.Soc., 131, 2009
3GJB
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CytC3 with Fe(II) and alpha-ketoglutarate
分子名称: 2-OXOGLUTARIC ACID, ACETATE ION, CytC3, ...
著者Wong, C, Drennan, C.L.
登録日2009-03-08
公開日2009-04-14
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Structural analysis of an open active site conformation of nonheme iron halogenase CytC3
J.Am.Chem.Soc., 131, 2009
4TM3
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Kutzneria sp. 744 ornithine N-hydroxylase, KtzI-FADox-Br
分子名称: BROMIDE ION, FLAVIN-ADENINE DINUCLEOTIDE, KtzI
著者Setser, J.W, Drennan, C.L.
登録日2014-05-30
公開日2014-09-17
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.09 Å)
主引用文献Crystallographic Evidence of Drastic Conformational Changes in the Active Site of a Flavin-Dependent N-Hydroxylase.
Biochemistry, 53, 2014
4TM0
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Kutzneria sp. 744 ornithine N-hydroxylase, KtzI-FADred-ox-NADP+-L-orn
分子名称: FLAVIN-ADENINE DINUCLEOTIDE, KtzI, L-ornithine, ...
著者Setser, J.W, Drennan, C.L.
登録日2014-05-30
公開日2014-09-17
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.74 Å)
主引用文献Crystallographic Evidence of Drastic Conformational Changes in the Active Site of a Flavin-Dependent N-Hydroxylase.
Biochemistry, 53, 2014

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