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6BEN
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BU of 6ben by Molmil
Solution structure of de novo macrocycle design8.2
分子名称: (DAR)Q(DPR)(DGN)R(DGL)PQ
著者Shortridge, M.D, Hosseinzadeh, P, Pardo-Avila, F, Varani, G, Baker, B.
登録日2017-10-25
公開日2017-12-27
最終更新日2023-06-14
実験手法SOLUTION NMR
主引用文献Comprehensive computational design of ordered peptide macrocycles.
Science, 358, 2017
5ET3
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BU of 5et3 by Molmil
Crystal Structure of De novo Designed Fullerene organizing peptide
分子名称: (C_{60}-I_{h})[5,6]fullerene, Fullerene Organizing Protein (C60Sol-COP-3)
著者Kim, K.-H, Kim, Y.H, Acharya, R, Kim, N.H, Paul, J, Grigoryan, G, DeGrado, W.F.
登録日2015-11-17
公開日2016-05-04
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.671 Å)
主引用文献Protein-directed self-assembly of a fullerene crystal.
Nat Commun, 7, 2016
5CWD
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BU of 5cwd by Molmil
Crystal structure of de novo designed helical repeat protein DHR7
分子名称: Designed helical repeat protein
著者Bhabha, G, Ekiert, D.C.
登録日2015-07-28
公開日2015-12-16
最終更新日2017-10-11
実験手法X-RAY DIFFRACTION (2.61 Å)
主引用文献Exploring the repeat protein universe through computational protein design.
Nature, 528, 2015
5CWI
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BU of 5cwi by Molmil
Crystal structure of de novo designed helical repeat protein DHR18
分子名称: Designed helical repeat protein, PHOSPHATE ION
著者Bhabha, G, Ekiert, D.C.
登録日2015-07-28
公開日2015-12-16
最終更新日2016-01-06
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Exploring the repeat protein universe through computational protein design.
Nature, 528, 2015
5KNG
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BU of 5kng by Molmil
CRYSTAL STRUCTURE OF ANTI-IL-13 DARPIN 6G9
分子名称: DARPIN 6G9, GLYCEROL, PHOSPHATE ION
著者Teplyakov, A, Malia, T, Obmolova, G, Gilliland, G.
登録日2016-06-28
公開日2016-12-14
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (1.35 Å)
主引用文献Conformational flexibility of an anti-IL-13 DARPin.
Protein Eng. Des. Sel., 30, 2017
8A3G
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BU of 8a3g by Molmil
X-ray crystal structure of a de novo designed antiparallel coiled-coil homotetramer with 4 heptad repeats, apCC-Tet*
分子名称: ACETATE ION, SODIUM ION, apCC-Tet*
著者Naudin, E.A, Mylemans, B, Albanese, K.I, Woolfson, D.N.
登録日2022-06-08
公開日2022-10-05
最終更新日2022-11-23
実験手法X-RAY DIFFRACTION (0.96 Å)
主引用文献From peptides to proteins: coiled-coil tetramers to single-chain 4-helix bundles.
Chem Sci, 13, 2022
8A3I
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BU of 8a3i by Molmil
X-ray crystal structure of a de novo designed antiparallel coiled-coil homotetramer with 3 heptad repeats, apCC-Tet*3
分子名称: apCC-Tet*3
著者Naudin, E.A, Mylemans, B, Albanese, K.I, Woolfson, D.N.
登録日2022-06-08
公開日2022-10-05
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (1.42 Å)
主引用文献From peptides to proteins: coiled-coil tetramers to single-chain 4-helix bundles.
Chem Sci, 13, 2022
8A3K
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BU of 8a3k by Molmil
X-ray crystal structure of a de novo designed single-chain antiparallel 4-helix coiled-coil bundle, sc-apCC-4
分子名称: sc-apCC-4
著者Albanese, K.I, Mylemans, B, Naudin, E.A, Woolfson, D.N.
登録日2022-06-08
公開日2022-10-05
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献From peptides to proteins: coiled-coil tetramers to single-chain 4-helix bundles.
Chem Sci, 13, 2022
8A3J
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BU of 8a3j by Molmil
X-ray crystal structure of a de novo designed antiparallel coiled-coil heterotetramer with 3 heptad repeats, apCC-Tet*3-A2B2
分子名称: apCC-Tet*3-A, apCC-Tet*3-B
著者Naudin, E.A, Mylemans, B, Albanese, K.I, Woolfson, D.N.
登録日2022-06-08
公開日2022-10-05
最終更新日2022-11-23
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献From peptides to proteins: coiled-coil tetramers to single-chain 4-helix bundles.
Chem Sci, 13, 2022
4IH3
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BU of 4ih3 by Molmil
2.5 Angstroms X-ray crystal structure of of human 2-amino-3-carboxymuconate-6-semialdehyde decarboxylase in complex with dipicolinic acid
分子名称: 2-amino-3-carboxymuconate-6-semialdehyde decarboxylase, PYRIDINE-2,6-DICARBOXYLIC ACID, ZINC ION
著者Huo, L, Liu, A.
登録日2012-12-18
公開日2014-05-21
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.493 Å)
主引用文献Human alpha-amino-beta-carboxymuconate-epsilon-semialdehyde decarboxylase (ACMSD): A structural and mechanistic unveiling.
Proteins, 83, 2015
4IGN
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BU of 4ign by Molmil
2.32 Angstrom X-ray Crystal structure of R47A mutant of human ACMSD
分子名称: 2-amino-3-carboxymuconate-6-semialdehyde decarboxylase, ZINC ION
著者Liu, F, Liu, A.
登録日2012-12-17
公開日2014-05-07
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.329 Å)
主引用文献Human alpha-amino-beta-carboxymuconate-epsilon-semialdehyde decarboxylase (ACMSD): A structural and mechanistic unveiling.
Proteins, 83, 2015
7KUW
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BU of 7kuw by Molmil
High-throughput design and refinement of stable proteins using sequence-only models
分子名称: Sequence-Based Designed Protein nmt_0994_guided_02
著者Bera, A.K, Stewart, L, Kang, A.S, Baker, D.
登録日2020-11-25
公開日2021-12-15
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2.43 Å)
主引用文献Large-scale design and refinement of stable proteins using sequence-only models.
Plos One, 17, 2022
6NL9
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BU of 6nl9 by Molmil
Crystal structure of de novo designed metal-controlled dimer of mutant B1 immunoglobulin-binding domain of Streptococcal Protein G (L12H, T16L, V29H, Y33H, N37L)-apo
分子名称: Immunoglobulin G-binding protein G, MAGNESIUM ION, SODIUM ION
著者Maniaci, B, Stec, B, Huxford, T.
登録日2019-01-08
公開日2019-01-23
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Design of High-Affinity Metal-Controlled Protein Dimers.
Biochemistry, 58, 2019
1LT1
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BU of 1lt1 by Molmil
SLIDING HELIX INDUCED CHANGE OF COORDINATION GEOMETRY IN A MODEL DI-MN(II) PROTEIN
分子名称: L13G-DF1, MANGANESE (II) ION
著者Di Costanzo, L, Geremia, S.
登録日2002-05-20
公開日2003-05-20
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.91 Å)
主引用文献Sliding helix and change of coordination geometry in a model di-MnII protein
Angew.Chem.Int.Ed.Engl., 42, 2003
6NLA
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BU of 6nla by Molmil
Crystal structure of de novo designed metal-controlled dimer of B1 immunoglobulin-binding domain of Streptococcal Protein G (L12H, E15V, T16L, T18I, V29H, Y33H, N37L)-zinc
分子名称: CHLORIDE ION, GLYCEROL, Immunoglobulin G-binding protein G, ...
著者Maniaci, B, Stec, B, Huxford, T.
登録日2019-01-08
公開日2019-01-23
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (1.34 Å)
主引用文献Design of High-Affinity Metal-Controlled Protein Dimers.
Biochemistry, 58, 2019
6NY8
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BU of 6ny8 by Molmil
Crystal structure of computationally designed protein XAA_GVDQ with calcium
分子名称: CALCIUM ION, CHLORIDE ION, Design construct XAA_GVDQ
著者Wei, K.Y, Bick, M.J.
登録日2019-02-11
公開日2020-04-22
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Computational design of closely related proteins that adopt two well-defined but structurally divergent folds.
Proc.Natl.Acad.Sci.USA, 117, 2020
6NYE
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BU of 6nye by Molmil
Crystal structure of computationally designed protein XAX
分子名称: Design construct XAX
著者Wei, K.Y, Bick, M.J.
登録日2019-02-11
公開日2020-04-22
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Computational design of closely related proteins that adopt two well-defined but structurally divergent folds.
Proc.Natl.Acad.Sci.USA, 117, 2020
6NXM
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BU of 6nxm by Molmil
Crystal structure of computationally designed protein XAA_GVDQ
分子名称: Design construct XAA_GVDQ
著者Wei, K.Y, Bick, M.J.
登録日2019-02-08
公開日2020-04-22
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Computational design of closely related proteins that adopt two well-defined but structurally divergent folds.
Proc.Natl.Acad.Sci.USA, 117, 2020
6NX2
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BU of 6nx2 by Molmil
Crystal structure of computationally designed protein AAA
分子名称: BROMIDE ION, Design construct AAA
著者Wei, K.Y, Bick, M.J.
登録日2019-02-07
公開日2020-04-22
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Computational design of closely related proteins that adopt two well-defined but structurally divergent folds.
Proc.Natl.Acad.Sci.USA, 117, 2020
6NZ3
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BU of 6nz3 by Molmil
Crystal structure of computationally designed protein XAA_GGHN
分子名称: CHLORIDE ION, Design construct XAA_GGHN
著者Wei, K.Y, Bick, M.J.
登録日2019-02-12
公開日2020-04-22
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Computational design of closely related proteins that adopt two well-defined but structurally divergent folds.
Proc.Natl.Acad.Sci.USA, 117, 2020
6NYI
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BU of 6nyi by Molmil
Crystal structure of computationally designed protein XXA
分子名称: Design construct XXA
著者Wei, K.Y, Bick, M.J.
登録日2019-02-11
公開日2020-04-22
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Computational design of closely related proteins that adopt two well-defined but structurally divergent folds.
Proc.Natl.Acad.Sci.USA, 117, 2020
6NYK
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BU of 6nyk by Molmil
Crystal structure of computationally designed protein XAX_GGDQ
分子名称: Design construct XAX_GGDQ
著者Wei, K.Y, Bick, M.J.
登録日2019-02-11
公開日2020-04-22
最終更新日2024-03-13
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Computational design of closely related proteins that adopt two well-defined but structurally divergent folds.
Proc.Natl.Acad.Sci.USA, 117, 2020
1N0D
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BU of 1n0d by Molmil
Stability of cyclic beta-hairpins: Asymmetric contibutions from side chains of hydrogen bonded cross-strand residue pair
分子名称: bhp_VWLH, disulfide cyclized beta-hairpin peptide
著者Russell, S.J, Blandl, T, Skelton, N.J, Cochran, A.G.
登録日2002-10-11
公開日2003-02-04
最終更新日2022-02-23
実験手法SOLUTION NMR
主引用文献Stability of Cyclic Beta-Hairpins: Asymmetric Contributions From Side Chains of Hydrogen Bonded Cross-Strand Residue Pair
J.Am.Chem.Soc., 125, 2003
6NZ1
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BU of 6nz1 by Molmil
Crystal structure of computationally designed protein XXA_GVDQ
分子名称: Design construct XXA_GVDQ
著者Wei, K.Y, Bick, M.J.
登録日2019-02-12
公開日2020-04-22
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Computational design of closely related proteins that adopt two well-defined but structurally divergent folds.
Proc.Natl.Acad.Sci.USA, 117, 2020
3JCI
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BU of 3jci by Molmil
2.9 Angstrom Resolution Cryo-EM 3-D Reconstruction of Close-packed PCV2 Virus-like Particles
分子名称: Capsid protein
著者Liu, Z, Guo, F, Wang, F, Li, T.C, Jiang, W.
登録日2015-12-13
公開日2016-02-03
最終更新日2024-02-21
実験手法ELECTRON MICROSCOPY (2.9 Å)
主引用文献2.9 angstrom Resolution Cryo-EM 3D Reconstruction of Close-Packed Virus Particles.
Structure, 24, 2016

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