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3HEX
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BU of 3hex by Molmil
Cyclic residues in alpha/beta-peptide helix bundles: GCN4-pLI side chain sequence on an (alpha-alpha-beta) backbone with cyclic beta-residues at positions 1, 4, 19 and 28
Descriptor: alpha/beta-peptide based on the GCN4-pLI side chain sequence with an (alpha-alpha-beta) backbone and cyclic beta-residues at positions 1, 4, 19 and 28
Authors:Horne, W.S, Price, J.L, Gellman, S.H.
Deposit date:2009-05-10
Release date:2010-04-21
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Structural consequences of beta-amino acid preorganization in a self-assembling alpha/beta-peptide: fundamental studies of foldameric helix bundles.
J.Am.Chem.Soc., 132, 2010
5U5C
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BU of 5u5c by Molmil
Coiled Coil Peptide Metal Coordination Framework: Tetramer Fold
Descriptor: COPPER (II) ION, Designed tetrameric coiled coil peptide with one terpyridine side chain, HEXANE-1,6-DIOL
Authors:Tavenor, N.A, Murnin, M.J, Horne, W.S.
Deposit date:2016-12-06
Release date:2017-02-22
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Supramolecular Metal-Coordination Polymers, Nets, and Frameworks from Synthetic Coiled-Coil Peptides.
J. Am. Chem. Soc., 139, 2017
5U5A
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BU of 5u5a by Molmil
Coiled Coil Peptide Metal Coordination Framework: Dimer Fold
Descriptor: COPPER (II) ION, Designed dimeric coiled coil peptide with two terpyridine side chains
Authors:Tavenor, N.A, Murnin, M.J, Horne, W.S.
Deposit date:2016-12-06
Release date:2017-02-22
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (3.23 Å)
Cite:Supramolecular Metal-Coordination Polymers, Nets, and Frameworks from Synthetic Coiled-Coil Peptides.
J. Am. Chem. Soc., 139, 2017
5UX1
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BU of 5ux1 by Molmil
Protein 43 with aldehyde deformylating oxygenase activity from Synechococcus
Descriptor: FE (III) ION, tRNA-(MS(2)IO(6)A)-hydroxylase-like
Authors:Wilson, D.K, Mak, W.S, Siegel, J.B.
Deposit date:2017-02-21
Release date:2018-02-28
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Protein 43 with aldehyde deformylating oxygenase activity from Synechococcus
To Be Published
5UUN
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BU of 5uun by Molmil
Crystal structure of SARO_2595 from Novosphingobium aromaticivorans
Descriptor: ACETATE ION, GLUTATHIONE, Glutathione S-transferase-like protein
Authors:Bingman, C.A, Kontur, W.S, Olmsted, C.N, Fox, B.G, Donohue, T.J.
Deposit date:2017-02-17
Release date:2018-02-28
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (1.45 Å)
Cite:Novosphingobium aromaticivoransuses a Nu-class glutathioneS-transferase as a glutathione lyase in breaking the beta-aryl ether bond of lignin.
J. Biol. Chem., 293, 2018
5UXI
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BU of 5uxi by Molmil
Protein 4 with aldehyde deformylating oxygenase activity from Nostoc puntiforme
Descriptor: Aldehyde decarbonylase, DECYLAMINE-N,N-DIMETHYL-N-OXIDE
Authors:Wilson, D.K, Mak, W.S, Siegel, J.B.
Deposit date:2017-02-22
Release date:2018-02-28
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (2 Å)
Cite:Protein 4 with aldehyde deformylating oxygenase activity from Nostoc puntiforme
To Be Published
5UX2
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BU of 5ux2 by Molmil
Protein 19 with aldehyde deformylating oxidase activity from Synechococcus
Descriptor: Aldehyde decarbonylase, FE (III) ION, PROPANOIC ACID
Authors:Wilson, D.K, Mak, W.S, Siegel, J.B.
Deposit date:2017-02-21
Release date:2018-02-28
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (1.99 Å)
Cite:Protein 19 with aldehyde deformylating oxidase activity from Synechococcus
To Be Published
5UUO
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BU of 5uuo by Molmil
Crystal structure of SARO_2595 from Novosphingobium aromaticivorans
Descriptor: 1,2-ETHANEDIOL, GLUTATHIONE, Glutathione S-transferase-like protein, ...
Authors:Bingman, C.A, Kontur, W.S, Olmsted, C.N, Fox, B.G, Donohue, T.J.
Deposit date:2017-02-17
Release date:2018-02-28
Last modified:2022-03-16
Method:X-RAY DIFFRACTION (1.25 Å)
Cite:Novosphingobium aromaticivoransuses a Nu-class glutathioneS-transferase as a glutathione lyase in breaking the beta-aryl ether bond of lignin.
J. Biol. Chem., 293, 2018
5UXG
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BU of 5uxg by Molmil
Protein 84 with aldehyde deformylating oxygenase activity from Sulfolobus tokodaii (monoclinic)
Descriptor: PHOSPHATE ION, aldehyde deformylating oxygenase
Authors:Wilson, D.K, Mak, W.S, Siegel, J.B.
Deposit date:2017-02-22
Release date:2018-02-28
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.72 Å)
Cite:Protein 84 with aldehyde deformylating oxygenase activity from Sulfolobus tokodaii (monoclinic)
To Be Published
5V4T
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BU of 5v4t by Molmil
Protein 84 with aldehyde deformylating oxygenase activity from Sulfolobus tokodaii (orthorhombic form)
Descriptor: 1,2-ETHANEDIOL, FE (III) ION, hypothetic aldehyde deformylating oxygenase
Authors:Wilson, D.K, Mak, W.S, Siegel, J.B.
Deposit date:2017-03-10
Release date:2018-03-14
Last modified:2023-10-04
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Protein 84 with aldehyde deformylating oxygenase activity from Sulfolobus tokodaii (orthorhombic form)
To Be Published
5US3
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BU of 5us3 by Molmil
Heterogeneous-backbone Foldamer Mimic of the Sp1-3 Zinc Finger
Descriptor: Heterogeneous-Backbone Variant of the Sp1-3 Zinc Finger: N-Me-Ala3, N-Me-Arg10, beta-3-Asp15, ...
Authors:George, K.L, Horne, W.S.
Deposit date:2017-02-13
Release date:2017-05-31
Last modified:2023-11-15
Method:SOLUTION NMR
Cite:Heterogeneous-Backbone Foldamer Mimics of Zinc Finger Tertiary Structure.
J. Am. Chem. Soc., 139, 2017
3IYS
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BU of 3iys by Molmil
Homology model of avian polyomavirus asymmetric unit
Descriptor: Major capsid protein VP1
Authors:Shen, P.S, Enderlein, D, Nelson, C.D.S, Carter, W.S, Kawano, M, Xing, L, Swenson, R.D, Olson, N.H, Baker, T.S, Cheng, R.H, Atwood, W.J, Johne, R, Belnap, D.M.
Deposit date:2010-04-19
Release date:2011-01-26
Last modified:2024-02-21
Method:ELECTRON MICROSCOPY (11.3 Å)
Cite:The structure of avian polyomavirus reveals variably sized capsids, non-conserved inter-capsomere interactions, and a possible location of the minor capsid protein VP4.
Virology, 411, 2011
3K1E
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BU of 3k1e by Molmil
Crystal structure of odorant binding protein 1 (AaegOBP1) from Aedes aegypti
Descriptor: 2,5,8,11,14,17,20,23,26,29,32,35,38,41,44,47,50,53,56,59,62,65,68,71,74,77,80-HEPTACOSAOXADOOCTACONTAN-82-OL, CHLORIDE ION, MAGNESIUM ION, ...
Authors:Leite, N.R, Krogh, R, Leal, W.S, Iulek, J, Oliva, G.
Deposit date:2009-09-27
Release date:2009-12-08
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Structure of an odorant-binding protein from the mosquito Aedes aegypti suggests a binding pocket covered by a pH-sensitive "Lid".
Plos One, 4, 2009
5X12
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BU of 5x12 by Molmil
Crystal structure of Bacillus subtilis PadR
Descriptor: Transcriptional regulator
Authors:Park, S.C, Kwak, Y.M, Song, W.S, Hong, M, Yoon, S.I.
Deposit date:2017-01-24
Release date:2017-11-22
Last modified:2024-03-20
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structural basis of effector and operator recognition by the phenolic acid-responsive transcriptional regulator PadR
Nucleic Acids Res., 45, 2017
5X11
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BU of 5x11 by Molmil
Crystal structure of Bacillus subtilis PadR in complex with operator DNA
Descriptor: DNA (28-MER), Transcriptional regulator
Authors:Park, S.C, Kwak, Y.M, Song, W.S, Hong, M, Yoon, S.I.
Deposit date:2017-01-24
Release date:2017-11-22
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (2.65 Å)
Cite:Structural basis of effector and operator recognition by the phenolic acid-responsive transcriptional regulator PadR
Nucleic Acids Res., 45, 2017
5X14
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BU of 5x14 by Molmil
Crystal structure of Bacillus subtilis PadR in complex with ferulic acid
Descriptor: 3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID, GLYCEROL, Transcriptional regulator
Authors:Park, S.C, Kwak, Y.M, Song, W.S, Hong, M, Yoon, S.I.
Deposit date:2017-01-24
Release date:2017-11-22
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (1.68 Å)
Cite:Structural basis of effector and operator recognition by the phenolic acid-responsive transcriptional regulator PadR
Nucleic Acids Res., 45, 2017
5X13
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BU of 5x13 by Molmil
Crystal structure of Bacillus subtilis PadR in complex with p-coumaric acid
Descriptor: 4'-HYDROXYCINNAMIC ACID, GLYCEROL, Transcriptional regulator
Authors:Park, S.C, Kwak, Y.M, Song, W.S, Hong, M, Yoon, S.I.
Deposit date:2017-01-24
Release date:2017-11-22
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structural basis of effector and operator recognition by the phenolic acid-responsive transcriptional regulator PadR
Nucleic Acids Res., 45, 2017
5XLJ
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BU of 5xlj by Molmil
Crystal structure of the flagellar cap protein flid D2-D3 domains from serratia marcescens in Space group P432
Descriptor: CHLORIDE ION, Flagellar hook-associated protein 2, SODIUM ION
Authors:Cho, S.Y, Song, W.S, Hong, H.J, Yoon, S.I.
Deposit date:2017-05-10
Release date:2017-06-14
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Tetrameric structure of the flagellar cap protein FliD from Serratia marcescens.
Biochem. Biophys. Res. Commun., 489, 2017
5XLK
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BU of 5xlk by Molmil
Crystal structure of the flagellar cap protein FliD D2-D3 domains from Serratia marcescens in Space group I422
Descriptor: Flagellar hook-associated protein 2, ZINC ION
Authors:Cho, S.Y, Song, W.S, Hong, H.J, Yoon, S.I.
Deposit date:2017-05-10
Release date:2017-06-14
Last modified:2023-11-22
Method:X-RAY DIFFRACTION (3.05 Å)
Cite:Tetrameric structure of the flagellar cap protein FliD from Serratia marcescens.
Biochem. Biophys. Res. Commun., 489, 2017
4KGR
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BU of 4kgr by Molmil
Backbone Modifications in the Protein GB1 Helix: beta-3-Ala24, beta-3-Lys28, beta-3-Lys31, beta-3-Asn35
Descriptor: GLYCEROL, Streptococcal Protein GB1 Backbone Modified Variant: beta-3-Ala24, beta-3-Lys28, ...
Authors:Reinert, Z.E, Lengyel, G.A, Horne, W.S.
Deposit date:2013-04-29
Release date:2013-09-04
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2 Å)
Cite:Protein-like Tertiary Folding Behavior from Heterogeneous Backbones.
J.Am.Chem.Soc., 135, 2013
4KGT
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BU of 4kgt by Molmil
Backbone Modifications in the Protein GB1 Turns: Aib10, D-Pro47
Descriptor: Streptococcal Protein GB1 Backbone Modified Variant: Aib10, D-Pro47
Authors:Reinert, Z.E, Lengyel, G.A, Horne, W.S.
Deposit date:2013-04-29
Release date:2013-09-04
Last modified:2023-12-06
Method:X-RAY DIFFRACTION (2 Å)
Cite:Protein-like Tertiary Folding Behavior from Heterogeneous Backbones.
J.Am.Chem.Soc., 135, 2013
5KNX
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BU of 5knx by Molmil
Crystal structure of E. coli hypoxanthine phosphoribosyltransferase in complexed with {[(2-[(Hypoxanthin-9H-yl)methyl]propane-1,3-diyl)bis(oxy)]bis- (methylene)}diphosphonic Acid
Descriptor: Hypoxanthine-guanine phosphoribosyltransferase, MAGNESIUM ION, [2-[(6-oxidanylidene-1~{H}-purin-9-yl)methyl]-3-(phosphonomethoxy)propoxy]methylphosphonic acid
Authors:Eng, W.S, Keough, D.T, Hockova, D, Janeba, Z, Guddat, L.W.
Deposit date:2016-06-28
Release date:2017-07-19
Last modified:2024-03-06
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Crystal Structures of Acyclic Nucleoside Phosphonates in Complex with Escherichia coli Hypoxanthine Phosphoribosyltransferase
Chemistryselect, 1, 2016
5KNR
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BU of 5knr by Molmil
E. coli HPRT in complexed with 9-[(N-phosphonoethyl-N-phosphonoethoxyethyl)-2-aminoethyl]-guanine
Descriptor: (2-{[2-(2-amino-6-oxo-3,6-dihydro-9H-purin-9-yl)ethyl][2-(2-phosphonoethoxy)ethyl]amino}ethyl)phosphonic acid, Hypoxanthine-guanine phosphoribosyltransferase, MAGNESIUM ION
Authors:Eng, W.S, Keough, D.T, Hockova, D, Janeba, Z.
Deposit date:2016-06-28
Release date:2017-07-19
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.864 Å)
Cite:Crystal Structures of Acyclic Nucleoside Phosphonates in Complex with Escherichia coli Hypoxanthine Phosphoribosyltransferase
Chemistryselect, 1, 2016
5KNU
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BU of 5knu by Molmil
Crystal structure of E. coli hypoxanthine phosphoribosyltransferase in complexed with 9-[N,N-(Bis-3-phosphonopropyl)aminomethyl]-9-deazahypoxanthine
Descriptor: 3-[(4-oxidanylidene-3,5-dihydropyrrolo[3,2-d]pyrimidin-7-yl)methyl-(3-phosphonopropyl)amino]propylphosphonic acid, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, Hypoxanthine-guanine phosphoribosyltransferase, ...
Authors:Eng, W.S, Keough, D.T, Baszczynski, O, Hockova, D, Janeba, Z.
Deposit date:2016-06-28
Release date:2017-07-19
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.808 Å)
Cite:Crystal Structures of Acyclic Nucleoside Phosphonates in Complex with Escherichia coli Hypoxanthine Phosphoribosyltransferase
Chemistryselect, 1, 2016
5KNT
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BU of 5knt by Molmil
Crystal structure of E. coli hypoxanthine phosphoribosyltransferase in complexed with 2-((2,3-Dihydroxypropyl)(2-(hypoxanthin-9-yl)ethyl)amino)ethylphosphonic acid
Descriptor: 2-[[(2~{S})-2,3-bis(oxidanyl)propyl]-[2-(6-oxidanylidene-1~{H}-purin-9-yl)ethyl]amino]ethylphosphonic acid, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, Hypoxanthine-guanine phosphoribosyltransferase, ...
Authors:Eng, W.S, Keough, D.T, Hockova, D, Janeba, Z.
Deposit date:2016-06-28
Release date:2017-07-19
Last modified:2023-09-27
Method:X-RAY DIFFRACTION (2.55 Å)
Cite:Crystal Structures of Acyclic Nucleoside Phosphonates in Complex with Escherichia coli Hypoxanthine Phosphoribosyltransferase
Chemistryselect, 1, 2016

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