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8CXL
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BU of 8cxl by Molmil
Structure of NapH3, a vanadium-dependent haloperoxidase homolog catalyzing the stereospecific alpha-hydroxyketone rearrangement reaction in napyradiomycin biosynthesis
Descriptor: CHLORIDE ION, MAGNESIUM ION, NapH3
Authors:Chen, P.Y.-T, Chekan, J.R, Moore, B.S.
Deposit date:2022-05-21
Release date:2022-08-31
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.98 Å)
Cite:Structural Basis of Stereospecific Vanadium-Dependent Haloperoxidase Family Enzymes in Napyradiomycin Biosynthesis.
Biochemistry, 61, 2022
8FFU
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BU of 8ffu by Molmil
Structure of GntC, a PLP-dependent enzyme catalyzing L-enduracididine biosynthesis from (S)-4-hydroxy-L-arginine, with the substrate bound
Descriptor: (2S,4S)-5-carbamimidamido-4-hydroxy-2-[(E)-({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methylidene)amino]pentanoic acid (non-preferred name), Aminotransferase class I/II-fold pyridoxal phosphate-dependent enzyme, MAGNESIUM ION
Authors:Chen, P.Y.-T, Moore, B.S.
Deposit date:2022-12-10
Release date:2023-04-12
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2.04 Å)
Cite:Mechanistic and Structural Insights into a Divergent PLP-Dependent l-Enduracididine Cyclase from a Toxic Cyanobacterium.
Acs Catalysis, 13, 2023
8FFT
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BU of 8fft by Molmil
Structure of GntC, a PLP-dependent enzyme catalyzing L-enduracididine biosynthesis from (S)-4-hydroxy-L-arginine
Descriptor: Aminotransferase class I/II-fold pyridoxal phosphate-dependent enzyme, MAGNESIUM ION
Authors:Chen, P.Y.-T, Lima, S.T, Chekan, J.R, Moore, B.S.
Deposit date:2022-12-10
Release date:2023-04-12
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Mechanistic and Structural Insights into a Divergent PLP-Dependent l-Enduracididine Cyclase from a Toxic Cyanobacterium.
Acs Catalysis, 13, 2023
6NSD
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BU of 6nsd by Molmil
Tar14, tryptophan C-6 flavin-dependent halogenase (chlorinase) from taromycin biosynthesis
Descriptor: FLAVIN-ADENINE DINUCLEOTIDE, SULFATE ION, Tryptophan halogenase
Authors:Luhavaya, H, Chekan, J.R, Moore, B.S.
Deposit date:2019-01-24
Release date:2019-04-24
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (1.74 Å)
Cite:Biosynthesis of l-4-Chlorokynurenine, an Antidepressant Prodrug and a Non-Proteinogenic Amino Acid Found in Lipopeptide Antibiotics.
Angew.Chem.Int.Ed.Engl., 58, 2019
6OHJ
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BU of 6ohj by Molmil
Crystal Structure of the Debrominase Bmp8 C82A in Complex with 2,3,4-tribromopyrrole
Descriptor: 2,3,4-tribromo-1H-pyrrole, Debrominase Bmp8, SULFATE ION
Authors:Chekan, J.R, Moore, B.S.
Deposit date:2019-04-05
Release date:2019-05-29
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (3.19 Å)
Cite:Bacterial Tetrabromopyrrole Debrominase Shares a Reductive Dehalogenation Strategy with Human Thyroid Deiodinase.
Biochemistry, 58, 2019
6OHI
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BU of 6ohi by Molmil
Crystal Structure of the Debrominase Bmp8 (Apo)
Descriptor: Debrominase Bmp8, SULFATE ION
Authors:Chekan, J.R, Moore, B.S.
Deposit date:2019-04-05
Release date:2019-05-29
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (2.27 Å)
Cite:Bacterial Tetrabromopyrrole Debrominase Shares a Reductive Dehalogenation Strategy with Human Thyroid Deiodinase.
Biochemistry, 58, 2019
7S2X
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BU of 7s2x by Molmil
Structure of SalC, a gamma-lactam-beta-lactone bicyclase for salinosporamide biosynthesis
Descriptor: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, POTASSIUM ION, SalC
Authors:Chen, P.Y.-T, Trivella, D.B.B, Bauman, K.D, Moore, B.S.
Deposit date:2021-09-04
Release date:2022-04-06
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.85 Å)
Cite:Enzymatic assembly of the salinosporamide gamma-lactam-beta-lactone anticancer warhead.
Nat.Chem.Biol., 18, 2022
7S5L
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BU of 7s5l by Molmil
Cembrene A synthase from Eleutherobia rubra
Descriptor: 1,2-ETHANEDIOL, CHLORIDE ION, Cembrene A synthase
Authors:Chen, P.Y.-T, Moore, B.S.
Deposit date:2021-09-10
Release date:2022-06-08
Method:X-RAY DIFFRACTION (1.58 Å)
Cite:Ancient plant-like terpene biosynthesis in corals.
Nat.Chem.Biol., 18, 2022
3W36
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BU of 3w36 by Molmil
Crystal structure of holo-type bacterial Vanadium-dependent chloroperoxidase
Descriptor: NapH1, VANADATE ION
Authors:Liscombe, D.K, Miyanaga, A, Fielding, E, Bernhardt, P, Li, A, Winter, J.M, Gilson, M.K, Noel, J.P, Moore, B.S.
Deposit date:2012-12-11
Release date:2013-12-11
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.97 Å)
Cite:Structural Basis of Stereospecific Vanadium-Dependent Haloperoxidase Family Enzymes in Napyradiomycin Biosynthesis.
Biochemistry, 2022
3W35
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BU of 3w35 by Molmil
Crystal structure of apo-type bacterial Vanadium-dependent chloroperoxidase
Descriptor: NapH1
Authors:Liscombe, D.K, Miyanaga, A, Fielding, E, Bernhardt, P, Li, A, Winter, J.M, Gilson, M.K, Noel, J.P, Moore, B.S.
Deposit date:2012-12-11
Release date:2013-12-11
Last modified:2022-08-31
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Structural Basis of Stereospecific Vanadium-Dependent Haloperoxidase Family Enzymes in Napyradiomycin Biosynthesis.
Biochemistry, 2022
3W8W
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BU of 3w8w by Molmil
The crystal structure of EncM
Descriptor: FLAVIN-ADENINE DINUCLEOTIDE, Putative FAD-dependent oxygenase EncM
Authors:Teufel, R, Miyanaga, A, Stull, F, Michaudel, Q, Louie, G, Noel, J.P, Baran, P.S, Palfey, B, Moore, B.S.
Deposit date:2013-03-22
Release date:2013-10-30
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Flavin-mediated dual oxidation controls an enzymatic Favorskii-type rearrangement.
Nature, 503, 2013
3W8Z
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BU of 3w8z by Molmil
The complex structure of EncM with hydroxytetraketide
Descriptor: (7S)-7-hydroxy-1-phenyloctane-1,3,5-trione, FLAVIN-ADENINE DINUCLEOTIDE, Putative FAD-dependent oxygenase EncM
Authors:Teufel, R, Miyanaga, A, Stull, F, Michaudel, Q, Louie, G, Noel, J.P, Baran, P.S, Palfey, B, Moore, B.S.
Deposit date:2013-03-22
Release date:2013-10-30
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Flavin-mediated dual oxidation controls an enzymatic Favorskii-type rearrangement.
Nature, 503, 2013
3W8X
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BU of 3w8x by Molmil
The complex structure of EncM with trifluorotriketide
Descriptor: 6,6,6-trifluoro-1-phenylhexane-1,3,5-trione, FLAVIN-ADENINE DINUCLEOTIDE, GLYCEROL, ...
Authors:Teufel, R, Miyanaga, A, Stull, F, Michaudel, Q, Louie, G, Noel, J.P, Baran, P.S, Palfey, B, Moore, B.S.
Deposit date:2013-03-22
Release date:2013-10-30
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.82 Å)
Cite:Flavin-mediated dual oxidation controls an enzymatic Favorskii-type rearrangement.
Nature, 503, 2013
2H84
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BU of 2h84 by Molmil
Crystal Structure of the C-terminal Type III Polyketide Synthase (PKS III) Domain of 'Steely1' (a Type I/III PKS Hybrid from Dictyostelium)
Descriptor: HEXAETHYLENE GLYCOL, Steely1
Authors:Austin, M.B, Saito, T, Bowman, M.E, Haydock, S, Kato, A, Moore, B.S, Kay, R.R, Noel, J.P.
Deposit date:2006-06-06
Release date:2006-08-22
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Biosynthesis of Dictyostelium discoideum differentiation-inducing factor by a hybrid type I fatty acid-type III polyketide synthase.
Nat.Chem.Biol., 2, 2006
6VKZ
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BU of 6vkz by Molmil
Crystal Structure of the N-prenyltransferase DabA in Complex with GSPP and Mg2+
Descriptor: DabA, GERANYL S-THIOLODIPHOSPHATE, MAGNESIUM ION
Authors:Chekan, J.R, Noel, J.P, Moore, B.S.
Deposit date:2020-01-22
Release date:2020-04-08
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Algal neurotoxin biosynthesis repurposes the terpene cyclase structural fold into anN-prenyltransferase.
Proc.Natl.Acad.Sci.USA, 117, 2020
6VL1
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BU of 6vl1 by Molmil
Crystal Structure of the N-prenyltransferase DabA in Complex with NGG and Mg2+
Descriptor: DabA, MAGNESIUM ION, N-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-L-glutamic acid
Authors:Chekan, J.R, Noel, J.P, Moore, B.S.
Deposit date:2020-01-22
Release date:2020-04-08
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Algal neurotoxin biosynthesis repurposes the terpene cyclase structural fold into anN-prenyltransferase.
Proc.Natl.Acad.Sci.USA, 117, 2020
6VL0
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BU of 6vl0 by Molmil
Crystal Structure of the N-prenyltransferase DabA in Complex with GSPP and Mn2+
Descriptor: DabA, GERANYL S-THIOLODIPHOSPHATE, MAGNESIUM ION, ...
Authors:Chekan, J.R, Noel, J.P, Moore, B.S.
Deposit date:2020-01-22
Release date:2020-04-08
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Algal neurotoxin biosynthesis repurposes the terpene cyclase structural fold into anN-prenyltransferase.
Proc.Natl.Acad.Sci.USA, 117, 2020
5BUK
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BU of 5buk by Molmil
Structure of flavin-dependent chlorinase Mpy16
Descriptor: FADH2-dependent halogenase, FLAVIN-ADENINE DINUCLEOTIDE, GLYCEROL
Authors:Agarwal, V, Louie, G.V, Noel, J.P, Moore, B.S.
Deposit date:2015-06-03
Release date:2016-03-09
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Biosynthesis of coral settlement cue tetrabromopyrrole in marine bacteria by a uniquely adapted brominase-thioesterase enzyme pair.
Proc.Natl.Acad.Sci.USA, 113, 2016
5BUL
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BU of 5bul by Molmil
Structure of flavin-dependent brominase Bmp2 triple mutant Y302S F306V A345W
Descriptor: FLAVIN-ADENINE DINUCLEOTIDE, flavin-dependent halogenase triple mutant
Authors:Agarwal, V, Louie, G.V, Noel, J.P, Moore, B.S.
Deposit date:2015-06-04
Release date:2016-03-09
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (1.9784 Å)
Cite:Biosynthesis of coral settlement cue tetrabromopyrrole in marine bacteria by a uniquely adapted brominase-thioesterase enzyme pair.
Proc.Natl.Acad.Sci.USA, 113, 2016
5BVA
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BU of 5bva by Molmil
Structure of flavin-dependent brominase Bmp2
Descriptor: 1,2-ETHANEDIOL, FLAVIN-ADENINE DINUCLEOTIDE, flavin-dependent halogenase
Authors:Agarwal, V, Louie, G.V, Noel, J.P, Moore, B.S.
Deposit date:2015-06-04
Release date:2016-03-09
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (1.873 Å)
Cite:Biosynthesis of coral settlement cue tetrabromopyrrole in marine bacteria by a uniquely adapted brominase-thioesterase enzyme pair.
Proc.Natl.Acad.Sci.USA, 113, 2016
1U0M
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BU of 1u0m by Molmil
Crystal Structure of 1,3,6,8-Tetrahydroxynaphthalene Synthase (THNS) from Streptomyces coelicolor A3(2): a Bacterial Type III Polyketide Synthase (PKS) Provides Insights into Enzymatic Control of Reactive Polyketide Intermediates
Descriptor: GLYCEROL, POLYETHYLENE GLYCOL (N=34), putative polyketide synthase
Authors:Austin, M.B, Izumikawa, M, Bowman, M.E, Udwary, D.W, Ferrer, J.L, Moore, B.S, Noel, J.P.
Deposit date:2004-07-13
Release date:2004-09-14
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (2.22 Å)
Cite:Crystal structure of a bacterial type III polyketide synthase and enzymatic control of reactive polyketide intermediates
J.Biol.Chem., 279, 2004
2O7B
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BU of 2o7b by Molmil
Tyrosine ammonia-lyase from Rhodobacter sphaeroides, complexed with coumarate
Descriptor: 4'-HYDROXYCINNAMIC ACID, Putative histidine ammonia-lyase
Authors:Louie, G.V, Bowman, M.E, Moffitt, M.C, Baiga, T.J, Moore, B.S, Noel, J.P.
Deposit date:2006-12-10
Release date:2007-01-16
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Structural determinants and modulation of substrate specificity in phenylalanine-tyrosine ammonia-lyases.
Chem.Biol., 13, 2006
2O7F
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BU of 2o7f by Molmil
Tyrosine ammonia-lyase from Rhodobacter sphaeroides (His89Phe variant), complexed with coumaric acid
Descriptor: 4'-HYDROXYCINNAMIC ACID, Putative histidine ammonia-lyase
Authors:Louie, G.V, Bowman, M.E, Moffitt, M.C, Baiga, T.J, Moore, B.S, Noel, J.P.
Deposit date:2006-12-11
Release date:2007-01-16
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structural determinants and modulation of substrate specificity in phenylalanine-tyrosine ammonia-lyases.
Chem.Biol., 13, 2006
2O78
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BU of 2o78 by Molmil
Tyrosine ammonia-lyase from Rhodobacter sphaeroides (His89Phe variant) complexed with cinnamic acid
Descriptor: PHENYLETHYLENECARBOXYLIC ACID, Putative histidine ammonia-lyase
Authors:Louie, G.V, Bowman, M.E, Moffitt, M.C, Baiga, T.J, Moore, B.S, Noel, J.P.
Deposit date:2006-12-10
Release date:2007-01-16
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Structural determinants and modulation of substrate specificity in phenylalanine-tyrosine ammonia-lyases.
Chem.Biol., 13, 2006
2NYF
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BU of 2nyf by Molmil
Crystal structure of phenylalanine ammonia-lyase from Nostoc punctiforme
Descriptor: Nostoc punctiforme phenylalanine ammonia lyase
Authors:Louie, G.V, Moffitt, M.C, Bowman, M.E, Pence, J, Noel, J.P, Moore, B.S.
Deposit date:2006-11-20
Release date:2007-02-06
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Discovery of Two Cyanobacterial Phenylalanine Ammonia Lyases: Kinetic and Structural Characterization.
Biochemistry, 46, 2007

 

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