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4U7W
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THE CRYSTAL STRUCTURE OF THE TERMINAL R DOMAIN FROM THE MYXALAMID PKS-NRPS BIOSYNTHETIC PATHWAY
Descriptor:MxaA, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ACETATE ION
Authors:Tsai, S.C., Keasling, J.D., Luo, R., Barajas, J.F., Phelan, R.M., Schaub, A.J., Kliewer, J.
Deposit date:2014-07-31
Release date:2015-08-12
Last modified:2017-09-13
Method:X-RAY DIFFRACTION (1.899 Å)
Cite:Comprehensive Structural and Biochemical Analysis of the Terminal Myxalamid Reductase Domain for the Engineered Production of Primary Alcohols.
Chem.Biol., 22, 2015
4W4T
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THE CRYSTAL STRUCTURE OF THE TERMINAL R DOMAIN FROM THE MYXALAMID PKS-NRPS BIOSYNTHETIC PATHWAY
Descriptor:MxaA, ACETATE ION
Authors:Tsai, S.C., Keasling, J.D., Luo, R., Barajas, J.F., Phelan, R.M., Schaub, A.J., Kliewer, J.
Deposit date:2014-08-15
Release date:2015-08-12
Last modified:2017-09-13
Method:X-RAY DIFFRACTION (1.845 Å)
Cite:Comprehensive Structural and Biochemical Analysis of the Terminal Myxalamid Reductase Domain for the Engineered Production of Primary Alcohols.
Chem.Biol., 22, 2015
4WV3
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CRYSTAL STRUCTURE OF THE ANTHRANILATE COA LIGASE AUAEII IN COMPLEX WITH ANTHRANOYL-AMP
Descriptor:Anthranilate-CoA ligase, 5'-O-[(S)-[(2-aminobenzoyl)oxy](hydroxy)phosphoryl]adenosine
Authors:Tsai, S.C., Muller, R., Jackson, D.R., Tu, S.S., Nguyen, M., Barajas, J.F., Pistorious, D., Krug, D.
Deposit date:2014-11-04
Release date:2015-11-11
Last modified:2017-09-20
Method:X-RAY DIFFRACTION (2.599 Å)
Cite:Structural Insights into Anthranilate Priming during Type II Polyketide Biosynthesis.
Acs Chem.Biol., 11, 2016
4XRT
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CRYSTAL STRUCTURE OF THE DI-DOMAIN ARO/CYC STFQ FROM THE STEFFIMYCIN BIOSYNTHETIC PATHWAY
Descriptor:StfQ Aromatase/Cyclase, FORMIC ACID
Authors:Tsai, S.C., Caldara-Festin, G.M., Jackson, D.R., Aguilar, S., Patel, A., Nguyen, M., Sasaki, E., Valentic, T.R., Barajas, J.F., Vo, M., Khanna, A., Liu, H.-W.
Deposit date:2015-01-21
Release date:2015-12-02
Last modified:2017-09-06
Method:X-RAY DIFFRACTION (1.952 Å)
Cite:Structural and functional analysis of two di-domain aromatase/cyclases from type II polyketide synthases.
Proc.Natl.Acad.Sci.USA, 112, 2015
4XRW
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CRYSTAL STRUCTURE OF THE DI-DOMAIN ARO/CYC BEXL FROM THE BE-7585A BIOSYNTHETIC PATHWAY
Descriptor:BexL, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID
Authors:Tsai, S.C., Caldara-Festin, G.M., Jackson, D.R., Aguilar, S., Patel, A., Nguyen, M., Sasaki, E., Valentic, T.R., Barajas, J.F., Vo, M., Khanna, A., Liu, H.-W.
Deposit date:2015-01-21
Release date:2015-12-02
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (1.79 Å)
Cite:Structural and functional analysis of two di-domain aromatase/cyclases from type II polyketide synthases.
Proc.Natl.Acad.Sci.USA, 112, 2015
5KBZ
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STRUCTURE OF THE PKSA PRODUCT TEMPLATE DOMAIN IN COMPLEX WITH A PHOSPHOPANTETHEINE MIMETIC
Descriptor:Noranthrone synthase, (14R)-14-hydroxy-15,15-dimethyl-1-[5-({[(5-methyl-1,2-oxazol-3-yl)methyl]sulfanyl}methyl)-1,2-oxazol-3-yl]-4,9,13-trioxo-2-thia-5,8,12-triazahexadecan-16-yl dihydrogen phosphate
Authors:Tsai, S.C., Burkart, M.D., Townsend, C.A., Barajas, J.F., Shakya, G., Topper, C.L., Moreno, G., Jackson, D.R., Rivera, H., La Clair, J.J., Vagstad, A.
Deposit date:2016-06-03
Release date:2017-05-10
Last modified:2017-09-27
Method:X-RAY DIFFRACTION (1.803 Å)
Cite:Polyketide mimetics yield structural and mechanistic insights into product template domain function in nonreducing polyketide synthases.
Proc. Natl. Acad. Sci. U.S.A., 114, 2017
1XR3
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ACTINORHODIN POLYKETIDE KETOREDUCTASE WITH NADP AND THE INHIBITOR ISONIAZID BOUND
Descriptor:ACTINORHODIN POLYKETIDE KETOREDUCTASE, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, 4-(DIAZENYLCARBONYL)PYRIDINE
Authors:Korman, T.P., Hill, J.A., Vu, T.N., Tsai, S.C.
Deposit date:2004-10-13
Release date:2005-09-27
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.71 Å)
Cite:Structural analysis of actinorhodin polyketide ketoreductase: cofactor binding and substrate specificity.
Biochemistry, 43, 2004
2A7S
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CRYSTAL STRUCTURE OF THE ACYL-COA CARBOXYLASE, ACCD5, FROM MYCOBACTERIUM TUBERCULOSIS
Descriptor:Probable propionyl-CoA carboxylase beta chain 5
Authors:Lin, T., Melgar, M., Purdon, J., Tseng, T., Tsai, S.C.
Deposit date:2005-07-06
Release date:2006-02-21
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Structure-based inhibitor design of AccD5, an essential acyl-CoA carboxylase carboxyltransferase domain of Mycobacterium tuberculosis.
Proc.Natl.Acad.Sci.Usa, 103, 2006
2RER
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CRYSTAL STRUCTURE OF THE AROMATASE/CYCLASE DOMAIN OF TCMN FROM STREPTOMYCES GLAUCESCENS
Descriptor:Multifunctional cyclase-dehydratase-3-O-methyl transferase tcmN
Authors:Ames, B.D., Korman, T.P., Vu, T.N., Tsai, S.C.
Deposit date:2007-09-26
Release date:2008-04-22
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Crystal structure and functional analysis of tetracenomycin ARO/CYC: implications for cyclization specificity of aromatic polyketides.
Proc.Natl.Acad.Sci.Usa, 105, 2008
2RES
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TETRACENOMYCIN ARO/CYC MUTANT R69A
Descriptor:Multifunctional cyclase-dehydratase-3-O-methyl transferase tcmN
Authors:Ames, B.D., Tsai, S.C.
Deposit date:2007-09-26
Release date:2008-04-22
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Crystal structure and functional analysis of tetracenomycin ARO/CYC: implications for cyclization specificity of aromatic polyketides.
Proc.Natl.Acad.Sci.Usa, 105, 2008
2REZ
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TETRACENOMYCIN ARO/CYC NAI STRUCTURE
Descriptor:Multifunctional cyclase-dehydratase-3-O-methyl transferase tcmN, ACETATE ION, IODIDE ION
Authors:Ames, B.D., Tsai, S.C.
Deposit date:2007-09-27
Release date:2008-04-22
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Crystal structure and functional analysis of tetracenomycin ARO/CYC: implications for cyclization specificity of aromatic polyketides.
Proc.Natl.Acad.Sci.Usa, 105, 2008
3HRQ
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THE PRODUCT TEMPLATE DOMAIN FROM PKSA WITH PALMITATE BOUND
Descriptor:Aflatoxin biosynthesis polyketide synthase, PALMITIC ACID
Authors:Korman, T.P., Tsai, S.C.
Deposit date:2009-06-09
Release date:2009-10-20
Last modified:2017-11-01
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Structural basis for biosynthetic programming of fungal aromatic polyketide cyclization.
Nature, 461, 2009
3HRR
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THE PRODUCT TEMPLATE DOMAIN FROM PKSA WITH HARRIS COMPOUND BOUND
Descriptor:Aflatoxin biosynthesis polyketide synthase, 1-(3-acetyl-4,5-dihydroxy-7-methoxynaphthalen-2-yl)propan-2-one
Authors:Korman, T.P., Tsai, S.C.
Deposit date:2009-06-09
Release date:2009-10-20
Last modified:2017-11-01
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Structural basis for biosynthetic programming of fungal aromatic polyketide cyclization.
Nature, 461, 2009
3TFZ
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CRYSTAL STRUCTURE OF ZHUI AROMATASE/CYCLASE FROM STREPTOMCYES SP. R1128
Descriptor:Cyclase, POTASSIUM ION, 3-CYCLOHEXYL-1-PROPYLSULFONIC ACID
Authors:Ames, B.D., Lee, M.Y., Moody, C., Zhang, W., Tang, Y., Wong, S.K., Tsai, S.C.
Deposit date:2011-08-16
Release date:2011-09-14
Last modified:2011-10-12
Method:X-RAY DIFFRACTION (2.39 Å)
Cite:Structural and Biochemical Characterization of ZhuI Aromatase/Cyclase from the R1128 Polyketide Pathway.
Biochemistry, 50, 2011
4KEH
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CROSSLINKED CRYSTAL STRUCTURE OF TYPE II FATTY SYNTHASE DEHYDRATASE, FABA, AND ACYL CARRIER PROTEIN, ACPP
Descriptor:N-{3-[DIHYDROXY(NONYL)-LAMBDA~4~-SULFANYL]PROPYL}-N~3~-[(2R)-2-HYDROXY-3,3-DIMETHYL-4-(PHOSPHONOOXY)BUTANOYL]-BETA-ALANINAMIDE, Acyl carrier protein, N-{3-[dihydroxy(nonyl)-lambda~4~-sulfanyl]propyl}-N~3~-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alaninamide
Authors:Nguyen, C., Haushalter, R., Finzel, K., Leong, J., Le, B.C., Burkart, M., Tsai, S.C.
Deposit date:2013-04-25
Release date:2013-12-25
Last modified:2014-01-29
Method:X-RAY DIFFRACTION (1.901 Å)
Cite:Trapping the dynamic acyl carrier protein in fatty acid biosynthesis.
Nature, 505, 2014
4XS7
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DETERMINING THE MOLECULAR BASIS FOR STARTER UNIT SELECTION DURING DAUNORUBICIN BIOSYNTHESIS
Descriptor:Daunorubicin-doxorubicin polyketide synthase
Authors:Jackson, D.R., Valentic, T.R., Tsai, S.C., Patel, A., Mohammed, L., Vasilakis, K., Wattana-amorn, P., Long, P.F., Crump, M.P., Crosby, J.
Deposit date:2015-01-22
Release date:2016-01-27
Last modified:2017-09-06
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Determining the Molecular Basis for Starter Unit Selection During Daunorubicin Biosynthesis
To Be Published
4XS9
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DETERMINING THE MOLECULAR BASIS FOR STARTER UNIT SELECTION DURING DAUNORUBICIN BIOSYNTHESIS
Descriptor:Daunorubicin-doxorubicin polyketide synthase, N~3~-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-N-[2-(propanoylamino)ethyl]-beta-alaninamide
Authors:Jackson, D.R., Valentic, T.R., Tsai, S.C., Patel, A., Mohammed, L., Vasilakis, K., Wattana-amorn, P., Long, P.F., Crump, M.P., Crosby, J.
Deposit date:2015-01-22
Release date:2016-01-27
Last modified:2017-09-06
Method:X-RAY DIFFRACTION (2.002 Å)
Cite:Determining the Molecular Basis for Starter Unit Selection During Daunorubicin Biosynthesis
To Be Published
4XSA
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DETERMINING THE MOLECULAR BASIS FOR STARTER UNIT SELECTION DURING DAUNORUBICIN BIOSYNTHESIS
Descriptor:Daunorubicin-doxorubicin polyketide synthase
Authors:Jackson, D.R., Valentic, T.R., Tsai, S.C., Patel, A., Mohammed, L., Vasilakis, K., Wattana-amorn, P., Long, P.F., Crump, M.P., Crosby, J.
Deposit date:2015-01-22
Release date:2016-01-27
Last modified:2017-09-06
Method:X-RAY DIFFRACTION (2.204 Å)
Cite:Determining the Molecular Basis for Starter Unit Selection During Daunorubicin Biosynthesis
To Be Published
4XSB
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DETERMINING THE MOLECULAR BASIS FOR STARTER UNIT SELECTION DURING DAUNORUBICIN BIOSYNTHESIS
Descriptor:Daunorubicin-doxorubicin polyketide synthase
Authors:Jackson, D.R., Valentic, T.R., Tsai, S.C., Patel, A., Mohammed, L., Vasilakis, K., Wattana-amorn, P., Long, P.F., Crump, M.P., Crosby, J.
Deposit date:2015-01-22
Release date:2016-01-27
Last modified:2017-09-13
Method:X-RAY DIFFRACTION (2.203 Å)
Cite:Determining the Molecular Basis for Starter Unit Selection During Daunorubicin Biosynthesis
To Be Published
5INF
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STRUCTURAL BASIS FOR ACYL-COA CARBOXYLASE-MEDIATED ASSEMBLY OF UNUSUAL POLYKETIDE SYNTHASE EXTENDER UNITS INCORPORATED INTO THE STAMBOMYCIN ANTIBIOTICS
Descriptor:Carboxyl transferase, HEXANOYL-COENZYME A
Authors:Valentic, T.R., Ray, L., Miyazawa, T., Withall, D.M., Song, L., Osada, H., Tsai, S.C., Challis, G.L.
Deposit date:2016-03-07
Release date:2016-12-28
Last modified:2017-09-13
Method:X-RAY DIFFRACTION (2.751 Å)
Cite:A crotonyl-CoA reductase-carboxylase independent pathway for assembly of unusual alkylmalonyl-CoA polyketide synthase extender units.
Nat Commun, 7, 2016
5ING
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A CROTONYL-COA REDUCTASE-CARBOXYLASE INDEPENDENT PATHWAY FOR ASSEMBLY OF UNUSUAL ALKYLMALONYL-COA POLYKETIDE SYNTHASE EXTENDER UNIT
Descriptor:Putative carboxyl transferase
Authors:Valentic, T.R., Ray, L., Miyazawa, T., Song, L., Withall, D.M., Milligan, J.C., Takahashi, S., Osada, H., Tsai, S.C., Challis, G.L.
Deposit date:2016-03-07
Release date:2016-12-28
Last modified:2017-09-13
Method:X-RAY DIFFRACTION (2.45 Å)
Cite:A crotonyl-CoA reductase-carboxylase independent pathway for assembly of unusual alkylmalonyl-CoA polyketide synthase extender units.
Nat Commun, 7, 2016
5INI
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STRUCTURAL BASIS FOR ACYL-COA CARBOXYLASE-MEDIATED ASSEMBLY OF UNUSUAL POLYKETIDE SYNTHASE EXTENDER UNITS INCORPORATED INTO THE STAMBOMYCIN ANTIBIOTICS
Descriptor:Putative carboxyl transferase, HEXANOYL-COENZYME A
Authors:Valentic, T.R., Ray, L., Miyazawa, T., Withall, D.M., Song, L., Milligan, J.C., Osada, H., Tsai, S.C., Challis, G.L.
Deposit date:2016-03-07
Release date:2016-12-28
Last modified:2017-09-13
Method:X-RAY DIFFRACTION (2.85 Å)
Cite:A crotonyl-CoA reductase-carboxylase independent pathway for assembly of unusual alkylmalonyl-CoA polyketide synthase extender units.
Nat Commun, 7, 2016
5KOF
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CROSSLINKED CRYSTAL STRUCTURE OF TYPE II FATTY ACID SYNTHASE KETOSYNTHASE, FABB, AND ACYL CARRIER PROTEIN, ACPP
Descriptor:3-oxoacyl-[acyl-carrier-protein] synthase 1, Acyl carrier protein, [(3~{S})-2,2-dimethyl-3-oxidanyl-4-oxidanylidene-4-[[3-oxidanylidene-3-[2-(prop-2-enoylamino)ethylamino]propyl]amino]butyl] dihydrogen phosphate
Authors:Milligan, J.C., Jackson, D.R., Barajas, J.F., Tsai, S.C.
Deposit date:2016-06-30
Release date:2018-01-24
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Crosslinked Crystal Structure of Type II Fatty Acid Synthase Ketosynthase, FabB, and Acyl Carrier Protein, AcpP
To Be Published
5THQ
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COMPREHENSIVE ANALYSIS OF A NOVEL KETOREDUCTASE FOR PENTANGULAR POLYPHENOL BIOSYNTHESIS
Descriptor:3-oxoacyl-ACP reductase, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Valentic, T.R., Tsai, S.C., Brady, S.F.
Deposit date:2016-09-30
Release date:2016-11-09
Last modified:2017-09-20
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Comprehensive Analysis of a Novel Ketoreductase for Pentangular Polyphenol Biosynthesis.
ACS Chem. Biol., 11, 2016
5TII
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COMPREHENSIVE ANALYSIS OF A NOVEL KETOREDUCTASE FOR PENTANGULAR POLYPHENOL BIOSYNTHESIS
Descriptor:3-oxoacyl-ACP reductase, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Valentic, T.R., Tsai, S.C., Brady, S.F.
Deposit date:2016-10-03
Release date:2016-11-09
Last modified:2016-12-28
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Comprehensive Analysis of a Novel Ketoreductase for Pentangular Polyphenol Biosynthesis.
ACS Chem. Biol., 11, 2016
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