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3HB8
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Structures of Thymidylate Synthase R163K with Substrates and Inhibitors Show Subunit Asymmetry
Descriptor: 1,2-ETHANEDIOL, 2'-DEOXYURIDINE 5'-MONOPHOSPHATE, PHOSPHATE ION, ...
Authors:Gibson, L.M, Lovelace, L.L, Lebioda, L.
Deposit date:2009-05-04
Release date:2010-05-26
Last modified:2024-02-21
Method:X-RAY DIFFRACTION (2.74 Å)
Cite:Structures of human thymidylate synthase R163K with dUMP, FdUMP and glutathione show asymmetric ligand binding.
Acta Crystallogr.,Sect.D, 67, 2011
2FS5
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Crystal structure of TDP-fucosamine acetyltransferase (WecD)- apo form
Descriptor: TDP-Fucosamine acetyltransferase, ZINC ION
Authors:Hung, M.N, Rangarajan, E, Munger, C, Nadeau, G, Sulea, T, Matte, A, Cygler, M, Montreal-Kingston Bacterial Structural Genomics Initiative (BSGI)
Deposit date:2006-01-20
Release date:2006-08-01
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.95 Å)
Cite:Crystal Structure of TDP-Fucosamine Acetyltransferase (WecD) from Escherichia coli, an Enzyme Required for Enterobacterial Common Antigen Synthesis.
J.Bacteriol., 188, 2006
2FTK
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berylloflouride Spo0F complex with Spo0B
Descriptor: MAGNESIUM ION, Sporulation initiation phosphotransferase B, Sporulation initiation phosphotransferase F
Authors:Varughese, K.I.
Deposit date:2006-01-24
Release date:2006-07-18
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (3.05 Å)
Cite:The Crystal Structure of Beryllofluoride Spo0F in Complex with the Phosphotransferase Spo0B Represents a Phosphotransfer Pretransition State.
J.Bacteriol., 188, 2006
3WQN
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Crystal structure of Rv3378c_Y51F with TPP
Descriptor: (2E)-3-methyl-5-[(1R,2S,8aS)-1,2,5,5-tetramethyl-1,2,3,5,6,7,8,8a-octahydronaphthalen-1-yl]pent-2-en-1-yl trihydrogen diphosphate, Diterpene synthase, PHOSPHATE ION
Authors:Chan, H.C, Feng, X, Ko, T.P, Huang, C.H, Hu, Y, Zheng, Y, Bogue, S, Nakano, C, Hoshino, T, Zhang, L, Lv, P, Liu, W, Crick, D.C, Liang, P.H, Wang, A.H, Oldfield, E, Guo, R.T.
Deposit date:2014-01-28
Release date:2014-02-26
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Structure and inhibition of tuberculosinol synthase and decaprenyl diphosphate synthase from Mycobacterium tuberculosis.
J.Am.Chem.Soc., 136, 2014
3WSA
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BU of 3wsa by Molmil
The Tuberculosis Drug SQ109 Inhibits Trypanosoma cruzi Cell Proliferation and acts Synergistically with Posaconazole
Descriptor: N-[(2Z)-3,7-dimethylocta-2,6-dien-1-yl]-N'-[(1R,3S,5R,7R)-tricyclo[3.3.1.1~3,7~]dec-2-yl]ethane-1,2-diamine, Squalene synthase
Authors:Shang, N, Li, Q, Huang, C.H, Oldfield, E, Guo, R.T.
Deposit date:2014-03-05
Release date:2015-04-01
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:SQ109, a new drug lead for Chagas disease.
Antimicrob.Agents Chemother., 59, 2015
3WU2
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Crystal structure analysis of Photosystem II complex
Descriptor: (3R)-beta,beta-caroten-3-ol, 1,2-DI-O-ACYL-3-O-[6-DEOXY-6-SULFO-ALPHA-D-GLUCOPYRANOSYL]-SN-GLYCEROL, 1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLE, ...
Authors:Umena, Y, Kawakami, K, Shen, J.R, Kamiya, N.
Deposit date:2014-04-21
Release date:2014-09-03
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Crystal structure of oxygen-evolving photosystem II at a resolution of 1.9 A
Nature, 473, 2011
3WEJ
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Crystal structure of the human squalene synthase F288A mutant in complex with presqualene pyrophosphate
Descriptor: MAGNESIUM ION, Squalene synthase, {(1R,2R,3R)-2-[(3E)-4,8-dimethylnona-3,7-dien-1-yl]-2-methyl-3-[(1E,5E)-2,6,10-trimethylundeca-1,5,9-trien-1-yl]cyclopropyl}methyl trihydrogen diphosphate
Authors:Liu, C.I, Jeng, W.Y, Wang, A.H.J.
Deposit date:2013-07-07
Release date:2014-02-12
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2 Å)
Cite:Structural insights into the catalytic mechanism of human squalene synthase.
Acta Crystallogr.,Sect.D, 70, 2014
3H9K
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Structures of Thymidylate Synthase R163K with Substrates and Inhibitors Show Subunit Asymmetry
Descriptor: 1,2-ETHANEDIOL, 5-FLUORO-2'-DEOXYURIDINE-5'-MONOPHOSPHATE, PHOSPHATE ION, ...
Authors:Gibson, L.M, Lovelace, L.L, Lebioda, L.
Deposit date:2009-04-30
Release date:2010-05-12
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.65 Å)
Cite:Structures of human thymidylate synthase R163K with dUMP, FdUMP and glutathione show asymmetric ligand binding.
Acta Crystallogr.,Sect.D, 67, 2011
3WKG
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Crystal structure of cellobiose 2-epimerase in complex with glucosylmannose
Descriptor: CHLORIDE ION, Cellobiose 2-epimerase, PHOSPHATE ION, ...
Authors:Fujiwara, T, Saburi, W, Tanaka, I, Yao, M.
Deposit date:2013-10-21
Release date:2013-12-25
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.47 Å)
Cite:Structural Insights into the Epimerization of beta-1,4-Linked Oligosaccharides Catalyzed by Cellobiose 2-Epimerase, the Sole Enzyme Epimerizing Non-anomeric Hydroxyl Groups of Unmodified Sugars
J.Biol.Chem., 289, 2014
3WD7
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Type III polyketide synthase
Descriptor: COENZYME A, NICKEL (II) ION, SULFATE ION, ...
Authors:Mori, T, Shimokawa, Y, Matsui, T, Kato, R, Sugio, S, Morita, H, Abe, I.
Deposit date:2013-06-10
Release date:2013-09-04
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:Cloning, characterization, and crystal structure analysis of novel type III polyketide synthases from Citrus microcarpa
To be Published
2D52
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BU of 2d52 by Molmil
Pentaketide chromone synthase (M207G mutant complexed with Coa)
Descriptor: COENZYME A, pentaketide chromone synthase
Authors:Kohno, T, Morita, H.
Deposit date:2005-10-27
Release date:2006-11-14
Last modified:2021-11-10
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Structural Insight into Chain-Length Control and Product Specificity of Pentaketide Chromone Synthase from Aloe arborescens
Chem.Biol., 14, 2007
3WR7
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Crystal Structure of Spermidine Acetyltransferase from Escherichia coli
Descriptor: COENZYME A, SPERMIDINE, Spermidine N1-acetyltransferase
Authors:Sugiyama, S, Ishikawa, S, Tomitori, S, Niiyama, M, Hirose, M, Miyazaki, Y, Higashi, K, Adachi, H, Takano, K, Murakami, S, Inoue, T, Mori, Y, Kashiwagi, K, Igarashi, K, Matsumura, H.
Deposit date:2014-02-20
Release date:2015-09-02
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Molecular mechanism underlying promiscuous polyamine recognition by spermidine acetyltransferase
Int.J.Biochem.Cell Biol., 76, 2016
3WCC
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BU of 3wcc by Molmil
The complex structure of TcSQS with ligand, E5700
Descriptor: (3R)-3-({2-benzyl-6-[(3R,4S)-3-hydroxy-4-methoxypyrrolidin-1-yl]pyridin-3-yl}ethynyl)-1-azabicyclo[2.2.2]octan-3-ol, Farnesyltransferase, putative
Authors:Shang, N, Li, Q, Ko, T.P, Chan, H.C, Huang, C.H, Ren, F, Zheng, Y, Zhu, Z, Chen, C.C, Guo, R.T.
Deposit date:2013-05-27
Release date:2014-06-18
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.32 Å)
Cite:Squalene synthase as a target for Chagas disease therapeutics.
Plos Pathog., 10, 2014
3WD8
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TypeIII polyketide synthases
Descriptor: GLYCEROL, Type III polyketide synthase quinolone synthase
Authors:Mori, T, Shimokawa, Y, Matsui, T, Morita, H, Abe, I.
Deposit date:2013-06-10
Release date:2013-09-04
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.463 Å)
Cite:Cloning, characterization, and crystal structure analysis of novel type III polyketide synthases from Citrus microcarpa
To be Published
3WEG
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BU of 3weg by Molmil
Crystal structure of the human squalene synthase in complex with farnesyl thiopyrophosphate and magnesium ion
Descriptor: MAGNESIUM ION, S-[(2E,6E)-3,7,11-TRIMETHYLDODECA-2,6,10-TRIENYL] TRIHYDROGEN THIODIPHOSPHATE, Squalene synthase
Authors:Liu, C.I, Jeng, W.Y, Wang, A.H.J.
Deposit date:2013-07-07
Release date:2014-02-12
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Structural insights into the catalytic mechanism of human squalene synthase.
Acta Crystallogr.,Sect.D, 70, 2014
4B7V
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BU of 4b7v by Molmil
Structure of wild type Pseudomonas aeruginosa FabF (KASII)
Descriptor: 3-OXOACYL-[ACYL-CARRIER-PROTEIN] SYNTHASE 2, POTASSIUM ION
Authors:Lecker, L, Baum, B, Zoltner, M, Hunter, W.N.
Deposit date:2012-08-22
Release date:2013-09-04
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.73 Å)
Cite:Structures of Pseudomonas Aeruginosa Beta-Keto-Acyl-(Acyl-Carrier-Protein) Synthase II (Fabf) and a C164Q Mutant Provide Templates for Antibacterial Drug Discovery and Identify a Buried Potassium Ion and a Ligand-Binding Site that is an Artefact of the Crystal Form
Acta Crystallogr.,Sect.F, 71, 2015
4B0N
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BU of 4b0n by Molmil
Crystal structure of PKS-I from the brown algae Ectocarpus siliculosus
Descriptor: ARACHIDONIC ACID, MALONIC ACID, POLYKETIDE SYNTHASE III
Authors:Leroux, C, Meslet-Cladiere, L, Delage, L, Goulitquer, S, Leblanc, C, Ar Gall, E, Stiger-Pouvreau, V, Potin, P, Czjzek, M.
Deposit date:2012-07-03
Release date:2013-07-10
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.85 Å)
Cite:Structure/Function Analysis of a Type III Polyketide Synthase in the Brown Alga Ectocarpus Siliculosus Reveals a Biochemical Pathway in Phlorotannin Monomer Biosynthesis.
Plant Cell, 25, 2013
3H49
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Crystal structure of a putative Ribokinase (Apo Form) from E.coli at 1.8A resolution
Descriptor: Ribokinase
Authors:Satyanarayana, L, Eswaramoorthy, S, Burley, S.K, Swaminathan, S, New York SGX Research Center for Structural Genomics (NYSGXRC)
Deposit date:2009-04-18
Release date:2009-04-28
Last modified:2021-02-10
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal structure of a putative Ribokinase (Apo Form) from E.coli at 1.8A resolution.
To be Published
2D3T
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BU of 2d3t by Molmil
Fatty Acid beta-oxidation multienzyme complex from Pseudomonas Fragi, Form V
Descriptor: 3-ketoacyl-CoA thiolase, ACETYL COENZYME *A, Fatty oxidation complex alpha subunit, ...
Authors:Tsuchiya, D, Shimizu, N, Ishikawa, M, Suzuki, Y, Morikawa, K.
Deposit date:2005-10-01
Release date:2006-02-21
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (3.4 Å)
Cite:Ligand-Induced Domain Rearrangement of Fatty Acid beta-Oxidation Multienzyme Complex
Structure, 14, 2006
4B3I
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BU of 4b3i by Molmil
Crystal structure of Mycobacterium tuberculosis fatty acid beta- oxidation complex with CoenzymeA bound at the hydratase active sites
Descriptor: ADENOSINE-5'-DIPHOSPHATE, COENZYME A, FATTY ACID BETA-OXIDATION COMPLEX ALPHA-CHAIN FADB, ...
Authors:Venkatesan, R, Wierenga, R.K.
Deposit date:2012-07-24
Release date:2013-03-27
Last modified:2024-05-08
Method:X-RAY DIFFRACTION (2.63 Å)
Cite:Structure of Mycobacterial Beta-Oxidation Trifunctional Enzyme Reveals its Altered Assembly and Putative Substrate Channeling Pathway.
Acs Chem.Biol., 8, 2013
2D51
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Pentaketide chromone synthase (M207G mutant)
Descriptor: pentaketide chromone synthase
Authors:Kohno, T, Morita, H.
Deposit date:2005-10-27
Release date:2006-11-14
Last modified:2021-11-10
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Structural Insight into Chain-Length Control and Product Specificity of Pentaketide Chromone Synthase from Aloe arborescens
Chem.Biol., 14, 2007
3HBB
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BU of 3hbb by Molmil
Structures of dihydrofolate reductase-thymidylate synthase of Trypanosoma cruzi in the folate-free state and in complex with two antifolate drugs, trimetrexate and methotrexate
Descriptor: 1,2-ETHANEDIOL, Dihydrofolate reductase-thymidylate synthase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Schormann, N, Senkovich, O, Chattopadhyay, D.
Deposit date:2009-05-04
Release date:2009-05-19
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (3 Å)
Cite:Structures of dihydrofolate reductase-thymidylate synthase of Trypanosoma cruzi in the folate-free state and in complex with two antifolate drugs, trimetrexate and methotrexate.
Acta Crystallogr.,Sect.D, 65, 2009
2D4O
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Crystal structure of TTHA1254 (I68M mutant) from Thermus thermophilus HB8
Descriptor: hypothetical protein TTHA1254
Authors:Mizohata, E, Uchikubo, T, Kinoshita, Y, Terada, T, Shirouzu, M, Kuramitsu, S, Yokoyama, S, RIKEN Structural Genomics/Proteomics Initiative (RSGI)
Deposit date:2005-10-21
Release date:2006-04-21
Last modified:2021-11-10
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Crystal structure of TTHA1254 (I68M mutant) from Thermus thermophilus HB8
To be Published
4BI9
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Crystal structure of wild-type SCP2 thiolase from Trypanosoma brucei.
Descriptor: 3-KETOACYL-COA THIOLASE, PUTATIVE
Authors:Harijan, R.K, Kiema, T.-R, Weiss, M.S, Michels, P.A.M, Wierenga, R.K.
Deposit date:2013-04-10
Release date:2013-08-14
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.45 Å)
Cite:Crystal Structures of Scp2-Thiolases of Trypanosomatidae, Human Pathogens Causing Widespread Tropical Diseases: The Importance for Catalysis of the Cysteine of the Unique Hdcf Loop.
Biochem.J., 455, 2013
2FQ1
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Crystal structure of the two-domain non-ribosomal peptide synthetase EntB containing isochorismate lyase and aryl-carrier protein domains
Descriptor: 1,2-ETHANEDIOL, CHLORIDE ION, Isochorismatase, ...
Authors:Drake, E.J, Nicolai, D.A, Gulick, A.M.
Deposit date:2006-01-17
Release date:2006-05-02
Last modified:2023-08-30
Method:X-RAY DIFFRACTION (2.3 Å)
Cite: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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