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8F54
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BU of 8f54 by Molmil
Top-down design of protein architectures with reinforcement learning
分子名称: RC_I_1
著者Borst, A.J, Baker, D.
登録日2022-11-11
公開日2023-05-10
最終更新日2024-06-19
実験手法ELECTRON MICROSCOPY (2.5 Å)
主引用文献Top-down design of protein architectures with reinforcement learning.
Science, 380, 2023
6IEI
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BU of 6iei by Molmil
Loop deletion and proline insertion mutant (deleting six residues and inserted five proline residues)
分子名称: Outer surface protein A
著者Shiga, S, Makabe, K.
登録日2018-09-14
公開日2019-07-03
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Domain-Swapping Design by Polyproline Rod Insertion.
Chembiochem, 20, 2019
6IMH
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BU of 6imh by Molmil
Solution Structure of Bicyclic Peptide pb-18
分子名称: (ACE)-GLY-CYS-PRO-CYS-GLU-PRO-SER-TYR-LEU-CYS-PRO-TRP-LEU-PRO-GLY-CYS-(NH2)
著者Yao, H, Lin, P, Zha, J, Zha, M, Zhao, Y, Wu, C.
登録日2018-10-22
公開日2019-08-28
実験手法SOLUTION NMR
主引用文献Ordered and Isomerically Stable Bicyclic Peptide Scaffolds Constrained through Cystine Bridges and Proline Turns.
Chembiochem, 20, 2019
8F4X
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BU of 8f4x by Molmil
Top-down design of protein architectures with reinforcement learning
分子名称: RC_I_1-H11
著者Borst, A.J, Baker, D.
登録日2022-11-11
公開日2023-05-10
最終更新日2024-06-19
実験手法ELECTRON MICROSCOPY (3.01 Å)
主引用文献Top-down design of protein architectures with reinforcement learning.
Science, 380, 2023
8F53
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BU of 8f53 by Molmil
Top-down design of protein architectures with reinforcement learning
分子名称: RC_I_2
著者Borst, A.J, Baker, D.
登録日2022-11-11
公開日2023-05-10
最終更新日2024-06-19
実験手法ELECTRON MICROSCOPY (2.93 Å)
主引用文献Top-down design of protein architectures with reinforcement learning.
Science, 380, 2023
4H8O
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BU of 4h8o by Molmil
Crystal structure of a parallel 6-helix coiled coil CC-Hex-N24
分子名称: CC-Hex-N24
著者Chi, B, Zaccai, N.R, Brady, R.L, Woolfson, D.N.
登録日2012-09-23
公開日2014-02-05
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.598 Å)
主引用文献TBA
To be Published
4H8L
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BU of 4h8l by Molmil
Crystal structure of a parallel 6-helix coiled coil CC-Hex-D24-A5/7C
分子名称: CC-Hex-D24-A5/7C
著者Chi, B, Zaccai, N.R, Brady, R.L, Woolfson, D.N.
登録日2012-09-23
公開日2014-02-05
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.7501 Å)
主引用文献TBA
J.Am.Chem.Soc.
1N0Q
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BU of 1n0q by Molmil
3ANK: A designed ankyrin repeat protein with three identical consensus repeats
分子名称: 3 ankyrin repeats, trifluoroacetic acid
著者Mosavi, L.K, Minor Jr, D.L, Peng, Z.-Y.
登録日2002-10-14
公開日2003-01-28
最終更新日2024-02-14
実験手法X-RAY DIFFRACTION (1.26 Å)
主引用文献Consensus-derived structural determinants of the ankyrin repeat motif.
Proc.Natl.Acad.Sci.USA, 99, 2002
8ERW
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BU of 8erw by Molmil
Precisely patterned nanofibers made from extendable protein multiplexes
分子名称: C2HR4_8r
著者Bick, M.J, Parmeggiani, F, Bethel, N.P, Sankaran, B, Baker, D.
登録日2022-10-12
公開日2023-08-23
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (2.88 Å)
主引用文献Precisely patterned nanofibres made from extendable protein multiplexes.
Nat.Chem., 15, 2023
8EOZ
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BU of 8eoz by Molmil
Precisely patterned nanofibers made from extendable protein multiplexes
分子名称: C3HR3_4r
著者Bera, A.K, Bethel, N.P, Kang, A.
登録日2022-10-04
公開日2023-08-16
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献Precisely patterned nanofibres made from extendable protein multiplexes.
Nat.Chem., 15, 2023
8EOV
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BU of 8eov by Molmil
Precisely patterned nanofibers made from extendable protein multiplexes
分子名称: C2HR1_4r, PHOSPHATE ION
著者Bera, A.K, Bethel, N.P.
登録日2022-10-04
公開日2023-08-16
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (1.59 Å)
主引用文献Precisely patterned nanofibres made from extendable protein multiplexes.
Nat.Chem., 15, 2023
8EOX
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BU of 8eox by Molmil
Precisely patterned nanofibers made from extendable protein multiplexes
分子名称: C4HR1_4r
著者Bera, A.K, Bethel, N.P.
登録日2022-10-04
公開日2023-08-16
最終更新日2023-12-20
実験手法X-RAY DIFFRACTION (3.3 Å)
主引用文献Precisely patterned nanofibres made from extendable protein multiplexes.
Nat.Chem., 15, 2023
4HDG
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BU of 4hdg by Molmil
Crystal Structure of viral RdRp in complex with GTP
分子名称: GUANOSINE-5'-TRIPHOSPHATE, Polyprotein, ZINC ION
著者Surana, P, Nair, D.T.
登録日2012-10-02
公開日2013-12-25
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.38 Å)
主引用文献RNA-dependent RNA polymerase of Japanese encephalitis virus binds the initiator nucleotide GTP to form a mechanistically important pre-initiation state.
Nucleic Acids Res., 42, 2014
4H8M
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BU of 4h8m by Molmil
Crystal structure of a parallel 6-helix coiled coil CC-Hex-H24-A5/7C
分子名称: CC-Hex-H24-A5/7C
著者Chi, B, Zaccai, N.R, Brady, R.L, Woolfson, D.N.
登録日2012-09-23
公開日2014-02-05
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.4292 Å)
主引用文献TBD
To be Published
7CCO
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BU of 7cco by Molmil
The binding structure of a lanthanide binding tag (LBT3) with lanthanum ion (La3+)
分子名称: LANTHANUM (III) ION, LBT3
著者Hatanaka, T, Kikkawa, N, Matsugami, A, Hosokawa, Y, Hayashi, F, Ishida, N.
登録日2020-06-17
公開日2021-04-28
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献The origins of binding specificity of a lanthanide ion binding peptide.
Sci Rep, 10, 2020
7CMJ
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BU of 7cmj by Molmil
Crystal structure of L.donovani Hypoxanthine-guanine phosphoribosyl transferase (HGPRT)
分子名称: BARIUM ION, CHLORIDE ION, DI(HYDROXYETHYL)ETHER, ...
著者Parihar, P.S, Pratap, J.V.
登録日2020-07-27
公開日2021-08-04
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.76 Å)
主引用文献The L.donovani Hypoxanthine-guanine phosphoribosyl transferase (HGPRT) oligomer is distinct from the human homolog.
Biochem.Biophys.Res.Commun., 532, 2020
6JON
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BU of 6jon by Molmil
Crystal structures of phage NrS-1 N300-dNTPs-Mg2+ complex provide molecular mechanisms for substrate specificity
分子名称: 2'-DEOXYADENOSINE 5'-TRIPHOSPHATE, MAGNESIUM ION, Primase
著者Guo, H.J, Li, M.J, Wu, H, Yu, F, He, J.H.
登録日2019-03-22
公開日2019-06-26
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.34 Å)
主引用文献Crystal structures of phage NrS-1 N300-dNTPs-Mg2+complex provide molecular mechanisms for substrate specificity.
Biochem.Biophys.Res.Commun., 515, 2019
4H8G
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BU of 4h8g by Molmil
crystal structure of a parallel 6-helix coiled coil CC-Hex-IL- 22
分子名称: CC-Hex-IL-22
著者Chi, B, Zaccai, N.R, Brady, R.L, Woolfson, D.N.
登録日2012-09-22
公開日2014-02-05
実験手法X-RAY DIFFRACTION (1.699 Å)
主引用文献TBA
J.Am.Chem.Soc.
6JOP
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BU of 6jop by Molmil
Crystal structures of phage NrS-1 N300-dNTPs-Mg2+ complex provide molecular mechanisms for substrate specificity
分子名称: MAGNESIUM ION, Primase, THYMIDINE-5'-TRIPHOSPHATE
著者Guo, H.J, Li, M.J, Wu, H, Yu, F, He, J.H.
登録日2019-03-22
公開日2019-06-26
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.353 Å)
主引用文献Crystal structures of phage NrS-1 N300-dNTPs-Mg2+complex provide molecular mechanisms for substrate specificity.
Biochem.Biophys.Res.Commun., 515, 2019
7CCN
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BU of 7ccn by Molmil
The binding structure of a lanthanide binding tag (LBT3) with lutetium ion (Lu3+)
分子名称: LBT3, LUTETIUM (III) ION
著者Hatanaka, T, Kikkawa, N, Matsugami, A, Hosokawa, Y, Hayashi, F, Ishida, N.
登録日2020-06-17
公開日2021-04-28
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献The origins of binding specificity of a lanthanide ion binding peptide.
Sci Rep, 10, 2020
4KGS
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BU of 4kgs by Molmil
Backbone Modifications in the Protein GB1 Loops: beta-3-Val21, beta-3-Asp40
分子名称: GLYCEROL, Streptococcal Protein GB1 Backbone Modified Variant: beta-3-Val21, beta-3-Asp40
著者Reinert, Z.E, Lengyel, G.A, Horne, W.S.
登録日2013-04-29
公開日2013-09-04
最終更新日2024-07-10
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Protein-like Tertiary Folding Behavior from Heterogeneous Backbones.
J.Am.Chem.Soc., 135, 2013
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
分子名称: GLYCEROL, Streptococcal Protein GB1 Backbone Modified Variant: beta-3-Ala24, beta-3-Lys28, ...
著者Reinert, Z.E, Lengyel, G.A, Horne, W.S.
登録日2013-04-29
公開日2013-09-04
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献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
分子名称: Streptococcal Protein GB1 Backbone Modified Variant: Aib10, D-Pro47
著者Reinert, Z.E, Lengyel, G.A, Horne, W.S.
登録日2013-04-29
公開日2013-09-04
最終更新日2023-12-06
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Protein-like Tertiary Folding Behavior from Heterogeneous Backbones.
J.Am.Chem.Soc., 135, 2013
4KYV
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BU of 4kyv by Molmil
Crystal Structure of dehalogenase HaloTag2 with HALTS at the resolution 1.8A. Northeast Structural Genomics Consortium (NESG) Target OR150
分子名称: N-(2-ethoxy-3,5-dimethylbenzyl)-1H-tetrazol-5-amine, SODIUM ION, dehalogenase HaloTag2
著者Kuzin, A, Lew, S, Seetharaman, J, Maglaqui, M, Xiao, R, Kohan, E, Wang, H, Everett, J.K, Acton, T.B, Kornhaber, G, Montelione, G.T, Hunt, J.F, Tong, L, Northeast Structural Genomics Consortium (NESG)
登録日2013-05-29
公開日2013-07-24
最終更新日2023-12-06
実験手法X-RAY DIFFRACTION (1.796 Å)
主引用文献Northeast Structural Genomics Consortium Target OR150
To be Published
4KUP
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BU of 4kup by Molmil
Endothiapepsin in complex with 20mM acylhydrazone inhibitor
分子名称: (2S)-2-azanyl-3-(3H-indol-3-yl)-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]propanamide, ACETATE ION, DIMETHYL SULFOXIDE, ...
著者Radeva, N, Heine, A, Klebe, G.
登録日2013-05-22
公開日2014-04-02
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.311 Å)
主引用文献Structure-based design of inhibitors of the aspartic protease endothiapepsin by exploiting dynamic combinatorial chemistry.
Angew.Chem.Int.Ed.Engl., 53, 2014

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