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4NDK
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BU of 4ndk by Molmil
Crystal structure of a computational designed engrailed homeodomain variant fused with YFP
分子名称: E23P-YFP, GFP-like fluorescent chromoprotein FP506, related, ...
著者Mou, Y, Mayo, S.L.
登録日2013-10-26
公開日2014-11-05
最終更新日2017-10-18
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Using Molecular Dynamics Simulations as an Aid in the Prediction of Domain Swapping of Computationally Designed Protein Variants.
J.Mol.Biol., 427, 2015
4NDJ
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BU of 4ndj by Molmil
Crystal Structure of a computational designed engrailed homeodomain variant fused with YFP
分子名称: Green fluorescent protein, chimeric construct,GFP-like fluorescent chromoprotein FP506, related
著者Mou, Y, Mayo, S.L.
登録日2013-10-26
公開日2014-11-05
最終更新日2017-10-18
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Using Molecular Dynamics Simulations as an Aid in the Prediction of Domain Swapping of Computationally Designed Protein Variants.
J.Mol.Biol., 427, 2015
6C9I
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BU of 6c9i by Molmil
Single-Particle reconstruction of DARP14 - A designed protein scaffold displaying ~17kDa DARPin proteins - Scaffold
分子名称: DARP14 - Subunit A with DARPin, DARP14 - Subunit B
著者Gonen, S, Liu, Y, Yeates, T.O, Gonen, T.
登録日2018-01-26
公開日2018-03-21
最終更新日2024-03-13
実験手法ELECTRON MICROSCOPY (3.09 Å)
主引用文献Near-atomic cryo-EM imaging of a small protein displayed on a designed scaffolding system.
Proc. Natl. Acad. Sci. U.S.A., 115, 2018
6C9K
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BU of 6c9k by Molmil
Single-Particle reconstruction of DARP14 - A designed protein scaffold displaying ~17kDa DARPin proteins
分子名称: DARP14 - Subunit A with DARPin, DARP14 - Subunit B
著者Gonen, S, Liu, Y, Yeates, T.O, Gonen, T.
登録日2018-01-26
公開日2018-03-21
最終更新日2024-03-13
実験手法ELECTRON MICROSCOPY (3.49 Å)
主引用文献Near-atomic cryo-EM imaging of a small protein displayed on a designed scaffolding system.
Proc. Natl. Acad. Sci. U.S.A., 115, 2018
3R2X
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BU of 3r2x by Molmil
Crystal structure of the de novo designed binding protein HB36.3 in complex the the 1918 influenza virus hemagglutinin
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, HB36.3, designed hemagglutinin binding protein, ...
著者Ekiert, D.C, Wilson, I.A.
登録日2011-03-14
公開日2011-05-11
最終更新日2020-07-29
実験手法X-RAY DIFFRACTION (3.1 Å)
主引用文献Computational design of proteins targeting the conserved stem region of influenza hemagglutinin.
Science, 332, 2011
3LJM
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BU of 3ljm by Molmil
Structure of de novo designed apo peptide coil SER L9C
分子名称: 1,2-ETHANEDIOL, CALCIUM ION, COIL SER L9C, ...
著者Chakraborty, S.
登録日2010-01-26
公開日2010-09-15
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (1.36 Å)
主引用文献Structural comparisons of apo- and metalated three-stranded coiled coils clarify metal binding determinants in thiolate containing designed peptides.
J.Am.Chem.Soc., 132, 2010
4PN8
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BU of 4pn8 by Molmil
A de novo designed pentameric coiled coil CC-Pent.
分子名称: CC-Pent
著者Wood, C.W, Burton, A.J, Thomson, A.R, Brady, R.L, Woolfson, D.N.
登録日2014-05-23
公開日2014-10-22
最終更新日2017-09-13
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Computational design of water-soluble alpha-helical barrels.
Science, 346, 2014
2KIK
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BU of 2kik by Molmil
An artificial di-iron oxo-protein with phenol oxidase activity
分子名称: Artificial diiron protein, ZINC ION
著者Maglio, O, Lombardi, A.
登録日2009-05-06
公開日2009-11-10
最終更新日2022-03-16
実験手法SOLUTION NMR
主引用文献An artificial di-iron oxo-protein with phenol oxidase activity
To be Published
4J9T
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BU of 4j9t by Molmil
Crystal structure of a putative, de novo designed unnatural amino acid dependent metalloprotein, northeast structural genomics consortium target OR61
分子名称: ARSENIC, GLYCEROL, designed unnatural amino acid dependent metalloprotein
著者Forouhar, F, Lew, S, Seetharaman, J, Mills, J.H, Khare, S.D, Everett, J.K, Baker, D, Montelione, G.T, Hunt, J.F, Tong, L, Northeast Structural Genomics Consortium (NESG)
登録日2013-02-17
公開日2013-03-27
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Computational design of an unnatural amino Acid dependent metalloprotein with atomic level accuracy.
J.Am.Chem.Soc., 135, 2013
2MLB
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BU of 2mlb by Molmil
NMR solution structure of a computational designed protein based on template of human erythrocytic ubiquitin
分子名称: redesigned ubiquitin
著者Xiong, P, Wang, M, Zhang, J, Chen, Q, Liu, H.
登録日2014-02-21
公開日2014-10-29
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Protein design with a comprehensive statistical energy function and boosted by experimental selection for foldability
Nat Commun, 5, 2014
6JCC
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BU of 6jcc by Molmil
structure of a de novo protein D_1CY5_M1
分子名称: Computational designed protein based on evolution
著者Meng, W, Feng, T.
登録日2019-01-28
公開日2019-03-13
最終更新日2024-03-27
実験手法X-RAY DIFFRACTION (1.45 Å)
主引用文献structure of a computationally designed mutant protein D_1CY5_M1
To Be Published
8VSW
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BU of 8vsw by Molmil
4-MERCAPTOPHENOL-ALPHA3C
分子名称: 4-mercaptophenol-alpha3C protein, 4-sulfanylphenol
著者Tommos, C.
登録日2024-01-24
公開日2024-03-27
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Switching the proton-coupled electron transfer mechanism for non-canonical tyrosine residues in a de novo protein.
Chem Sci, 15, 2024
7DCL
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BU of 7dcl by Molmil
Crystal structure of the Zn-directed tetramer of the engineered cyt cb 562 variant, C96I/A38S AB5
分子名称: CHLORIDE ION, HEME C, ZINC ION, ...
著者Song, W.J, Yu, J.
登録日2020-10-26
公開日2021-03-03
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.45 Å)
主引用文献Symmetry-related residues as promising hotspots for the evolution of de novo oligomeric enzymes.
Chem Sci, 12, 2021
6LDF
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BU of 6ldf by Molmil
Crystal structure of the Zn-directed tetramer of the engineered cyt cb 562 variant, C96K AB5
分子名称: CHLORIDE ION, HEME C, ZINC ION, ...
著者Song, W.J, Yu, J.
登録日2019-11-21
公開日2021-03-03
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.35 Å)
主引用文献Symmetry-related residues as promising hotspots for the evolution of de novo oligomeric enzymes.
Chem Sci, 12, 2021
6LDE
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BU of 6lde by Molmil
Crystal structure of the Zn-directed tetramer of the engineered cyt cb 562 variant, C96V AB5
分子名称: CHLORIDE ION, HEME C, ZINC ION, ...
著者Song, W.J, Yu, J.
登録日2019-11-21
公開日2021-03-03
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Symmetry-related residues as promising hotspots for the evolution of de novo oligomeric enzymes.
Chem Sci, 12, 2021
6LDG
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BU of 6ldg by Molmil
Crystal structure of the Zn-directed tetramer of the engineered cyt cb 562 variant, C96I AB5
分子名称: CHLORIDE ION, HEME C, MAGNESIUM ION, ...
著者Song, W.J, Yu, J.
登録日2019-11-21
公開日2021-03-03
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (1.98 Å)
主引用文献Symmetry-related residues as promising hotspots for the evolution of de novo oligomeric enzymes.
Chem Sci, 12, 2021
6FDB
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BU of 6fdb by Molmil
Positively supercharged variant of the computationally designed cage protein O3-33
分子名称: Propanediol utilization protein
著者Edwardson, T, Mori, T, Hilvert, D.
登録日2017-12-22
公開日2018-08-22
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (3.619 Å)
主引用文献Rational Engineering of a Designed Protein Cage for siRNA Delivery.
J. Am. Chem. Soc., 140, 2018
3V45
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BU of 3v45 by Molmil
Crystal Structure of de novo designed serine hydrolase OSH55, Northeast Structural Genomics Consortium Target OR130
分子名称: CHLORIDE ION, SODIUM ION, Serine hydrolase OSH55
著者Kuzin, A, Su, M, Seetharaman, J, Maglaqui, M, Xiao, R, Kohan, E, Rajagopalan, S, Everett, J.K, Nair, R, Acton, T.B, Rost, B, Baker, D, Montelione, G.T, Tong, L, Hunt, J.F, Northeast Structural Genomics Consortium (NESG)
登録日2011-12-14
公開日2012-01-04
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Design of activated serine-containing catalytic triads with atomic-level accuracy.
Nat.Chem.Biol., 10, 2014
5WP3
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BU of 5wp3 by Molmil
Crystal Structure of EED in complex with EB22
分子名称: EB22, Polycomb protein EED, UNKNOWN ATOM OR ION
著者Dong, C, Tempel, W, Zhu, L, Moody, J.D, Baker, D, Bountra, C, Arrowsmith, C.H, Edwards, A.M, Min, J, Structural Genomics Consortium (SGC)
登録日2017-08-03
公開日2017-09-13
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.55 Å)
主引用文献First critical repressive H3K27me3 marks in embryonic stem cells identified using designed protein inhibitor.
Proc. Natl. Acad. Sci. U.S.A., 114, 2017
6ER6
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BU of 6er6 by Molmil
Crystal structure of a computationally designed colicin endonuclease and immunity pair colEdes7/Imdes7
分子名称: Endonuclease colEdes7, immunity Imdes7
著者Netzer, R, Listov, D, Dym, O, Albeck, S, Knop, O, Fleishman, S.J.
登録日2017-10-17
公開日2019-01-30
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Ultrahigh specificity in a network of computationally designed protein-interaction pairs.
Nat Commun, 9, 2018
4ESS
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BU of 4ess by Molmil
Crystal Structure of E6D/L155R variant of de novo designed serine hydrolase OSH55, Northeast Structural Genomics Consortium (NESG) Target OR187
分子名称: OR187
著者Kuzin, A, Su, M, Seetharaman, J, Kornhaber, K, Kornhaber, G, Rajagopalan, S, Baker, D, Everett, J.K, Acton, T.B, Montelione, G.T, Tong, L, Hunt, J.F, Northeast Structural Genomics Consortium (NESG)
登録日2012-04-23
公開日2012-06-13
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.9971 Å)
主引用文献Design of activated serine-containing catalytic triads with atomic-level accuracy.
Nat.Chem.Biol., 10, 2014
4ETJ
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BU of 4etj by Molmil
Crystal Structure of E6H variant of de novo designed serine hydrolase OSH55, Northeast Structural Genomics Consortium (NESG) Target OR185
分子名称: 2-{2-[2-(2-{2-[2-(2-ETHOXY-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHOXY]-ETHOXY}-ETHANOL, 3,6,9,12,15,18,21,24-OCTAOXAHEXACOSAN-1-OL, CHLORIDE ION, ...
著者Kuzin, A, Su, M, Seetharaman, J, Kornhaber, K, Kornhaber, G, Rajagopalan, S, Baker, D, Everett, J.K, Acton, T.B, Montelione, G.T, Tong, L, Hunt, J.F, Northeast Structural Genomics Consortium (NESG)
登録日2012-04-24
公開日2012-06-13
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.203 Å)
主引用文献Design of activated serine-containing catalytic triads with atomic-level accuracy.
Nat.Chem.Biol., 10, 2014
6VFL
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BU of 6vfl by Molmil
BG505-SOSIP model reconstructed by subparticle extraction and refinement from a tetrahedral nanoparticle T33_dn10
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, BG505-SOSIPv5.2(7S) - gp120, ...
著者Antanasijevic, A, Ward, A.B.
登録日2020-01-05
公開日2020-07-22
最終更新日2020-08-26
実験手法ELECTRON MICROSCOPY (4.14 Å)
主引用文献Structural and functional evaluation of de novo-designed, two-component nanoparticle carriers for HIV Env trimer immunogens.
Plos Pathog., 16, 2020
8ED3
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BU of 8ed3 by Molmil
Structure of a nanoparticle with icosahedral symmetry
分子名称: Designed I3-01 icosahedron
著者McCarthy, S, Gonen, S.
登録日2022-09-02
公開日2023-01-11
実験手法ELECTRON MICROSCOPY (3.5 Å)
主引用文献Improved interface packing and design opportunities revealed by CryoEM analysis of a designed protein nanocage.
Heliyon, 8, 2022
6OHH
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BU of 6ohh by Molmil
Structure of EF1p2_mFAP2b bound to DFHBI
分子名称: (5Z)-5-(3,5-difluoro-4-hydroxybenzylidene)-2,3-dimethyl-3,5-dihydro-4H-imidazol-4-one, CALCIUM ION, EF1p2_mFAP2b
著者Doyle, L.A, Stoddard, B.L.
登録日2019-04-05
公開日2020-04-08
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Incorporation of sensing modalities into de novo designed fluorescence-activating proteins
Nat Commun, 12, 2021

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