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1PNV
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BU of 1pnv by Molmil
Crystal Structure of TDP-epi-Vancosaminyltransferase GtfA in complexes with TDP and Vancomycin
Descriptor: GLYCOSYLTRANSFERASE GTFA, THYMIDINE-5'-DIPHOSPHATE, VANCOMYCIN, ...
Authors:Mulichak, A.M, Losey, H.C, Lu, W, Wawrzak, Z, Walsh, C.T, Garavito, R.M.
Deposit date:2003-06-13
Release date:2003-08-12
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Structure of the Tdp-Epi-Vancosaminyltransferase Gtfa from the Chloroeremomycin Biosynthetic Pathway.
Proc.Natl.Acad.Sci.USA, 100, 2003
1PN3
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BU of 1pn3 by Molmil
Crystal Structure of TDP-epi-Vancosaminyltransferase GtfA in complexes with TDP and the acceptor substrate DVV.
Descriptor: DESVANCOSAMINYL VANCOMYCIN, GLYCOSYLTRANSFERASE GTFA, THYMIDINE-5'-DIPHOSPHATE, ...
Authors:Mulichak, A.M, Losey, H.C, Lu, W, Wawrzak, Z, Walsh, C.T, Garavito, R.M.
Deposit date:2003-06-12
Release date:2003-08-12
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Structure of the Tdp-Epi-Vancosaminyltransferase Gtfa from the Chloroeremomycin Biosynthetic Pathway.
Proc.Natl.Acad.Sci.USA, 100, 2003
1RRV
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BU of 1rrv by Molmil
X-ray crystal structure of TDP-vancosaminyltransferase GtfD as a complex with TDP and the natural substrate, desvancosaminyl vancomycin.
Descriptor: DESVANCOSAMINYL VANCOMYCIN, GLYCEROL, GLYCOSYLTRANSFERASE GTFD, ...
Authors:Mulichak, A.M, Lu, W, Losey, H.C, Walsh, C.T, Garavito, R.M.
Deposit date:2003-12-09
Release date:2004-05-18
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2 Å)
Cite:Crystal Structure of Vancosaminyltransferase Gtfd from the Vancomycin Biosynthetic Pathway: Interactions with Acceptor and Nucleotide Ligands
Biochemistry, 43, 2004
1CSA
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BU of 1csa by Molmil
THE MUTANT E.COLI F112W CYCLOPHILIN BINDS CYCLOSPORIN A IN NEARLY IDENTICAL CONFORMATION AS HUMAN CYCLOPHILIN
Descriptor: CYCLOSPORIN A
Authors:Fejzo, J, Walsh, C.T, Wagner, G.
Deposit date:1992-02-24
Release date:1994-04-30
Last modified:2012-12-12
Method:SOLUTION NMR
Cite:The Mutant Escherichia Coli F112W Cyclophilin Binds Cyclosporin a in Nearly Identical Conformation as Human Cyclophilin.
Biochemistry, 33, 1994
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
Descriptor: SULFATE ION, Surfactin Synthetase
Authors:Bruner, S.D, Weber, T, Kohli, R.M, Schwarzer, D, Marahiel, M.A, Walsh, C.T, Stubbs, M.T.
Deposit date:2001-07-18
Release date:2002-03-27
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.71 Å)
Cite:Structural basis for the cyclization of the lipopeptide antibiotic surfactin by the thioesterase domain SrfTE.
Structure, 10, 2002
1L5A
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BU of 1l5a by Molmil
Crystal Structure of VibH, an NRPS Condensation Enzyme
Descriptor: amide synthase
Authors:Keating, T.A, Marshall, C.G, Walsh, C.T, Keating, A.E.
Deposit date:2002-03-06
Release date:2002-06-26
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (2.55 Å)
Cite:The structure of VibH represents nonribosomal peptide synthetase condensation, cyclization and epimerization domains.
Nat.Struct.Biol., 9, 2002
2ISJ
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BU of 2isj by Molmil
BluB bound to oxidized FMN
Descriptor: BluB, FLAVIN MONONUCLEOTIDE
Authors:Larsen, N.A, Taga, M.E, Howard-Jones, A.R, Walsh, C.T, Walker, G.C.
Deposit date:2006-10-17
Release date:2007-03-27
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:BluB cannibalizes flavin to form the lower ligand of vitamin B12.
Nature, 446, 2007
2ISL
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BU of 2isl by Molmil
BluB bound to reduced flavin (FMNH2) and molecular oxygen. (clear crystal form)
Descriptor: 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
Authors:Larsen, N.A, Taga, M.E, Howard-Jones, A.R, Walsh, C.T, Walker, G.C.
Deposit date:2006-10-17
Release date:2007-03-27
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:BluB cannibalizes flavin to form the lower ligand of vitamin B12.
Nature, 446, 2007
2ISK
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BU of 2isk by Molmil
BluB bound to flavin anion (charge transfer complex)
Descriptor: 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
Authors:Larsen, N.A, Taga, M.E, Howard-Jones, A.R, Walsh, C.T, Walker, G.C.
Deposit date:2006-10-17
Release date:2007-03-27
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.1 Å)
Cite: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
Descriptor: Surfactin synthetase thioesterase subunit, Tyrocidine synthetase 3 (Tyrocidine synthetase III)
Authors: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.
Deposit date:2008-04-10
Release date:2008-12-09
Last modified:2024-05-01
Method:SOLUTION NMR
Cite:Structural basis for the selectivity of the external thioesterase of the surfactin synthetase.
Nature, 454, 2008
2LIW
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BU of 2liw by Molmil
NMR structure of HMG-ACPI domain from CurA module from Lyngbya majuscula
Descriptor: 3-HYDROXY-3-METHYL-GLUTARIC ACID, 4'-PHOSPHOPANTETHEINE, CurA
Authors: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.
Deposit date:2011-09-01
Release date:2011-12-21
Last modified:2012-03-14
Method:SOLUTION NMR
Cite: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
Descriptor: CurA
Authors: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.
Deposit date:2011-09-01
Release date:2011-12-14
Last modified:2024-05-15
Method:SOLUTION NMR
Cite:Characterization of Molecular Interactions between ACP and Halogenase Domains in the Curacin A Polyketide Synthase.
Acs Chem.Biol., 7, 2012
2MLP
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BU of 2mlp by Molmil
MICROCIN LEADER PEPTIDE FROM E. COLI, NMR, 25 STRUCTURES
Descriptor: MCBA PROPEPTIDE
Authors:Kim, S, Sinha Roy, R, Walsh, C.T, Baleja, J.D.
Deposit date:1998-01-21
Release date:1998-07-22
Last modified:2022-03-16
Method:SOLUTION NMR
Cite:Role of the microcin B17 propeptide in substrate recognition: solution structure and mutational analysis of McbA1-26.
Chem.Biol., 5, 1998
5T81
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BU of 5t81 by Molmil
Rhombohedral crystal form of the EpoB NRPS cyclization-docking bidomain from Sorangium cellulosum
Descriptor: EpoB, GLYCEROL
Authors:Dowling, D.P, Kung, Y, Croft, A.K, Taghizadeh, K, Kelly, W.L, Walsh, C.T, Drennan, C.L.
Deposit date:2016-09-06
Release date:2016-11-09
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (2.604 Å)
Cite: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
Descriptor: EpoB
Authors:Dowling, D.P, Kung, Y, Croft, A.K, Taghizadeh, K, Kelly, W.L, Walsh, C.T, Drennan, C.L.
Deposit date:2016-09-06
Release date:2016-11-09
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (2.03 Å)
Cite: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
Descriptor: 1(S)-AMINOETHYL-(2-CARBOXYPROPYL)PHOSPHORYL-PHOSPHINIC ACID, ADENOSINE-5'-DIPHOSPHATE, D-ALA:D-ALA LIGASE, ...
Authors:Knox, J.R, Moews, P.C, Fan, C.
Deposit date:1996-09-20
Release date:1997-02-12
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (1.9 Å)
Cite: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
Descriptor: 2-[(1-AMINO-ETHYL)-PHOSPHATE-PHOSPHINOYLOXY]-BUTYRIC ACID, ADENOSINE-5'-DIPHOSPHATE, D-ALA:D-ALA LIGASE, ...
Authors:Knox, J.R, Moews, P.C, Fan, C.
Deposit date:1996-09-20
Release date:1997-02-12
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (2.2 Å)
Cite: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
Descriptor: GLYCEROL, PCZA361.16, THYMIDINE-5'-PHOSPHATE
Authors:Merkel, A.B, Naismith, J.H.
Deposit date:2003-06-09
Release date:2004-06-03
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.4 Å)
Cite: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
3BMZ
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BU of 3bmz by Molmil
Violacein biosynthetic enzyme VioE
Descriptor: Putative uncharacterized protein, TETRAETHYLENE GLYCOL, TRIETHYLENE GLYCOL
Authors:Ryan, K.S, Drennan, C.L.
Deposit date:2007-12-13
Release date:2008-01-01
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (1.21 Å)
Cite:The Violacein Biosynthetic Enzyme VioE Shares a Fold with Lipoprotein Transporter Proteins
J.Biol.Chem., 283, 2008
4TM3
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BU of 4tm3 by Molmil
Kutzneria sp. 744 ornithine N-hydroxylase, KtzI-FADox-Br
Descriptor: BROMIDE ION, FLAVIN-ADENINE DINUCLEOTIDE, KtzI
Authors:Setser, J.W, Drennan, C.L.
Deposit date:2014-05-30
Release date:2014-09-17
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.09 Å)
Cite:Crystallographic Evidence of Drastic Conformational Changes in the Active Site of a Flavin-Dependent N-Hydroxylase.
Biochemistry, 53, 2014
4TM0
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BU of 4tm0 by Molmil
Kutzneria sp. 744 ornithine N-hydroxylase, KtzI-FADred-ox-NADP+-L-orn
Descriptor: FLAVIN-ADENINE DINUCLEOTIDE, KtzI, L-ornithine, ...
Authors:Setser, J.W, Drennan, C.L.
Deposit date:2014-05-30
Release date:2014-09-17
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.74 Å)
Cite:Crystallographic Evidence of Drastic Conformational Changes in the Active Site of a Flavin-Dependent N-Hydroxylase.
Biochemistry, 53, 2014
4TLX
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BU of 4tlx by Molmil
Kutzneria sp. 744 ornithine N-hydroxylase, KtzI-FADred-NADP+-L-orn
Descriptor: DIHYDROFLAVINE-ADENINE DINUCLEOTIDE, KtzI, L-ornithine, ...
Authors:Setser, J.W, Drennan, C.L.
Deposit date:2014-05-30
Release date:2014-09-17
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.23 Å)
Cite:Crystallographic Evidence of Drastic Conformational Changes in the Active Site of a Flavin-Dependent N-Hydroxylase.
Biochemistry, 53, 2014
4TM1
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BU of 4tm1 by Molmil
Kutzneria sp. 744 ornithine N-hydroxylase, KtzI-FADred-NADP+-Br
Descriptor: BROMIDE ION, DIHYDROFLAVINE-ADENINE DINUCLEOTIDE, KtzI, ...
Authors:Setser, J.W, Drennan, C.L.
Deposit date:2014-05-30
Release date:2014-09-17
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.39 Å)
Cite:Crystallographic Evidence of Drastic Conformational Changes in the Active Site of a Flavin-Dependent N-Hydroxylase.
Biochemistry, 53, 2014
4TLZ
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BU of 4tlz by Molmil
Kutzneria sp. 744 ornithine N-hydroxylase, KtzI-FADox-NADP+-L-orn
Descriptor: FLAVIN-ADENINE DINUCLEOTIDE, KtzI, L-ornithine, ...
Authors:Setser, J.W, Drennan, C.L.
Deposit date:2014-05-30
Release date:2014-09-17
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.411 Å)
Cite:Crystallographic Evidence of Drastic Conformational Changes in the Active Site of a Flavin-Dependent N-Hydroxylase.
Biochemistry, 53, 2014
4TM4
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BU of 4tm4 by Molmil
Kutzneria sp. 744 ornithine N-hydroxylase, KtzI-FADox-red-NADP+-Br
Descriptor: BROMIDE ION, DIHYDROFLAVINE-ADENINE DINUCLEOTIDE, KtzI, ...
Authors:Setser, J.W, Drennan, C.L.
Deposit date:2014-05-30
Release date:2014-09-17
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.632 Å)
Cite:Crystallographic Evidence of Drastic Conformational Changes in the Active Site of a Flavin-Dependent N-Hydroxylase.
Biochemistry, 53, 2014

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