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7OMK
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The NMR structure of the Zf-GRF domains from the mouse Endonuclease VIII-LIKE 3 (mNEIL3)
分子名称: Endonuclease 8-like 3
著者Dinesh, D.C, Huskova, A, Srb, P, Veverka, V, Silhan, J.
登録日2021-05-24
公開日2022-06-01
最終更新日2024-06-19
実験手法SOLUTION NMR
主引用文献Model of abasic site DNA cross-link repair; from the architecture of NEIL3 DNA binding domains to the X-structure model.
Nucleic Acids Res., 50, 2022
7JS6
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BU of 7js6 by Molmil
Solution NMR structure of des-citrulassin F
分子名称: des-citrulassin F
著者Harris, L.A, Mitchell, D.A.
登録日2020-08-13
公開日2020-12-16
最終更新日2023-06-14
実験手法SOLUTION NMR
主引用文献Reactivity-Based Screening for Citrulline-Containing Natural Products Reveals a Family of Bacterial Peptidyl Arginine Deiminases.
Acs Chem.Biol., 15, 2020
7UBF
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BU of 7ubf by Molmil
Solution NMR structure of 8-residue Rosetta-designed cyclic peptide D8.21 in 50% d6-DMSO and 50% water with cis/trans switching (CC conformation, 50%)
分子名称: Cyclic peptide D8.21 DVA-MLE-DPR-LEU-DVA-MLE-DPR-LEU
著者Ramelot, T.A, Tejero, R, Montelione, G.T.
登録日2022-03-14
公開日2022-09-14
最終更新日2022-09-28
実験手法SOLUTION NMR
主引用文献Accurate de novo design of membrane-traversing macrocycles.
Cell, 185, 2022
7UBD
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Solution NMR structure of 8-residue Rosetta-designed cyclic peptide D8.31 in d6-DMSO with cis/trans switching (A-CC conformation)
分子名称: Cyclic peptide D8.31 DAL-DPR-MLU-DVA-DAL-DPR-MLU-DVA
著者Ramelot, T.A, Tejero, R, Montelione, G.T.
登録日2022-03-14
公開日2022-09-14
最終更新日2022-09-28
実験手法SOLUTION NMR
主引用文献Accurate de novo design of membrane-traversing macrocycles.
Cell, 185, 2022
7UBI
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BU of 7ubi by Molmil
Solution NMR structure of 8-residue Rosetta-designed cyclic peptide D8.21 in CDCl3 with cis/trans switching (TT conformation, 47%)
分子名称: Cyclic peptide D8.21 DVA-MLE-DPR-LEU-DVA-MLE-DPR-LEU
著者Ramelot, T.A, Tejero, R, Montelione, G.T.
登録日2022-03-14
公開日2022-09-14
最終更新日2022-09-28
実験手法SOLUTION NMR
主引用文献Accurate de novo design of membrane-traversing macrocycles.
Cell, 185, 2022
7UBG
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BU of 7ubg by Molmil
Solution NMR structure of 9-residue Rosetta-designed cyclic peptide D9.16 in CDCl3 with cis/trans switching (A-TT conformation)
分子名称: Cyclic peptide D9.16 DPR-MAA-ALA-DVA-MLE-LEU-LEU-PRO-DLE
著者Ramelot, T.A, Tejero, R, Montelione, G.T.
登録日2022-03-14
公開日2022-09-14
最終更新日2022-09-28
実験手法SOLUTION NMR
主引用文献Accurate de novo design of membrane-traversing macrocycles.
Cell, 185, 2022
8XZ2
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BU of 8xz2 by Molmil
The structural model of a homodimeric D-Ala-D-Ala metallopeptidase, VanX, from vancomycin-resistant bacteria
分子名称: D-alanyl-D-alanine dipeptidase
著者Konuma, T, Takai, T, Tsuchiya, C, Nishida, M, Hashiba, M, Yamada, Y, Shirai, H, Motoda, Y, Nagadoi, A, Chikaishi, E, Akagi, K, Akashi, S, Yamazaki, T, Akutsu, H, Oe, A, Ikegami, T.
登録日2024-01-20
公開日2024-05-22
実験手法SOLUTION NMR
主引用文献Analysis of the homodimeric structure of a D-Ala-D-Ala metallopeptidase, VanX, from vancomycin-resistant bacteria.
Protein Sci., 33, 2024
6K8Q
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BU of 6k8q by Molmil
Solution structure of the intermembrane space domain of the mitochondrial import protein Tim21 from S. cerevisiae
分子名称: Mitochondrial import inner membrane translocase subunit TIM21
著者Bala, S, Shinya, S, Srivastava, A, Shimada, A, Kobayashi, N, Kojima, C, Tama, F, Miyashita, O, Kohda, D.
登録日2019-06-13
公開日2019-09-11
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Crystal contact-free conformation of an intrinsically flexible loop in protein crystal: Tim21 as the case study.
Biochim Biophys Acta Gen Subj, 1864, 2020
8H0G
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AQEE-30 in a HFIP solution
分子名称: AQEE-30
著者Park, O.-S, Jeon, Y.H, Cheong, C.
登録日2022-09-28
公開日2022-12-14
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Structure of AQEE-30 of VGF Neuropeptide in Membrane-Mimicking Environments.
Int J Mol Sci, 23, 2022
8H0U
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AQEE-30 in a DPC solution
分子名称: AQEE-30
著者Park, O.-S, Jeon, Y.H, Cheong, C.
登録日2022-09-30
公開日2022-12-14
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Structure of AQEE-30 of VGF Neuropeptide in Membrane-Mimicking Environments.
Int J Mol Sci, 23, 2022
8HEQ
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BU of 8heq by Molmil
Solution structure of the periplasmic domain of the anti-sigma factor RsgI2 from Clostridium thermocellum
分子名称: Anti-sigma-I factor RsgI2
著者Chen, C, Feng, Y.
登録日2022-11-08
公開日2023-05-24
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Essential autoproteolysis of bacterial anti-sigma factor RsgI for transmembrane signal transduction.
Sci Adv, 9, 2023
7NN6
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BU of 7nn6 by Molmil
periplasmic domain of Vibrio cholerae ToxR
分子名称: ToxR
著者Gubensaek, N, Wagner, G.E, Zangger, K.
登録日2021-02-24
公開日2021-04-07
最終更新日2021-06-30
実験手法SOLUTION NMR
主引用文献The periplasmic domains of Vibriocholerae ToxR and ToxS are forming a strong heterodimeric complex independent on the redox state of ToxR cysteines.
Mol.Microbiol., 115, 2021
7NM2
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BU of 7nm2 by Molmil
Solution structure of MLKL executioner domain in complex with a fragment
分子名称: 2-[(~{S})-methoxy-(4-propan-2-ylphenyl)methyl]-3~{H}-benzimidazole-5-carboxylic acid, Mixed lineage kinase domain-like protein
著者Ruebbelke, M, Bauer, M, Hamilton, J, Binder, F, Nar, H, Zeeb, M.
登録日2021-02-23
公開日2021-09-22
最終更新日2024-06-19
実験手法SOLUTION NMR
主引用文献Discovery and Structure-Based Optimization of Fragments Binding the Mixed Lineage Kinase Domain-like Protein Executioner Domain.
J.Med.Chem., 64, 2021
7NM5
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BU of 7nm5 by Molmil
Solution structure of MLKL executioner domain in complex with a fragment
分子名称: 2-[(~{S})-methoxy-(4-phenylphenyl)methyl]-3~{H}-benzimidazole-5-carboxylic acid, Mixed lineage kinase domain-like protein
著者Ruebbelke, M, Bauer, M, Hamilton, J, Binder, F, Nar, H, Zeeb, M.
登録日2021-02-23
公開日2021-09-22
最終更新日2024-06-19
実験手法SOLUTION NMR
主引用文献Discovery and Structure-Based Optimization of Fragments Binding the Mixed Lineage Kinase Domain-like Protein Executioner Domain.
J.Med.Chem., 64, 2021
7NM4
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BU of 7nm4 by Molmil
Solution structure of MLKL executioner domain in complex with a fragment
分子名称: (~{S})-1~{H}-benzimidazol-2-yl-(4-propan-2-ylphenyl)methanol, Mixed lineage kinase domain-like protein
著者Ruebbelke, M, Bauer, M, Hamilton, J, Binder, F, Nar, H, Zeeb, M.
登録日2021-02-23
公開日2021-09-22
最終更新日2024-06-19
実験手法SOLUTION NMR
主引用文献Discovery and Structure-Based Optimization of Fragments Binding the Mixed Lineage Kinase Domain-like Protein Executioner Domain.
J.Med.Chem., 64, 2021
8JIC
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BU of 8jic by Molmil
human telomere two-quartet G-quadruplex at pH 7.0
分子名称: DNA (5'-D(*TP*AP*GP*GP*GP*TP*TP*AP*GP*GP*GP*TP*TP*AP*GP*GP*GP*TP*TP*AP*GP*G)-3')
著者Wang, B, Galer, P, Plavec, J.
登録日2023-05-26
公開日2024-04-03
最終更新日2024-05-08
実験手法SOLUTION NMR
主引用文献Unveiling the structural mechanism of a G-quadruplex pH-Driven switch.
Biochimie, 214, 2023
8JIH
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BU of 8jih by Molmil
human telomere two-quartet G-quadruplex at pH 5.0
分子名称: DNA (5'-D(*TP*AP*GP*GP*GP*TP*TP*AP*GP*GP*GP*TP*TP*AP*GP*GP*GP*TP*TP*AP*GP*G)-3')
著者Wang, B, Galer, P, Plavec, J.
登録日2023-05-26
公開日2024-04-03
最終更新日2024-05-08
実験手法SOLUTION NMR
主引用文献Unveiling the structural mechanism of a G-quadruplex pH-Driven switch.
Biochimie, 214, 2023
8CWA
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BU of 8cwa by Molmil
Solution NMR structure of 8-residue Rosetta-designed cyclic peptide D8.21 in CDCl3 with cis/trans switching (TC conformation, 53%)
分子名称: Cyclic peptide D8.21 DVA-MLE-DPR-LEU-DVA-MLE-DPR-LEU
著者Ramelot, T.A, Tejero, R, Montelione, G.T.
登録日2022-05-18
公開日2022-09-14
最終更新日2022-09-28
実験手法SOLUTION NMR
主引用文献Accurate de novo design of membrane-traversing macrocycles.
Cell, 185, 2022
7DVM
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BU of 7dvm by Molmil
DgkA structure in E.coli lipid bilayer
分子名称: Diacylglycerol kinase
著者Li, J, Yang, J.
登録日2021-01-13
公開日2022-04-13
最終更新日2023-09-27
実験手法SOLID-STATE NMR
主引用文献Structure of membrane diacylglycerol kinase in lipid bilayers.
Commun Biol, 4, 2021
6W0O
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BU of 6w0o by Molmil
Amyloid-beta(1-40) fibril derived from Alzheimer's disease cortical tissue
分子名称: Amyloid-beta precursor protein
著者Ghosh, U, Thurber, K.R, Tycko, R.
登録日2020-03-02
公開日2021-01-13
最終更新日2024-05-15
実験手法ELECTRON MICROSCOPY (2.77 Å), SOLID-STATE NMR
主引用文献Molecular structure of a prevalent amyloid-beta fibril polymorph from Alzheimer's disease brain tissue.
Proc.Natl.Acad.Sci.USA, 118, 2021
8Q7J
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BU of 8q7j by Molmil
Conformations of macrocyclic peptides sampled by exact NOEs: models for cell-permeability
分子名称: CYCLOSPORIN A
著者Ruedisser, S.H, Matabaro, E, Sonderegger, L, Guentert, P, Kuenzler, M, Gossert, A.D.
登録日2023-08-16
公開日2023-12-06
最終更新日2024-01-03
実験手法SOLUTION NMR
主引用文献Conformations of Macrocyclic Peptides Sampled by Nuclear Magnetic Resonance: Models for Cell-Permeability.
J.Am.Chem.Soc., 145, 2023
8E2O
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BU of 8e2o by Molmil
Leveraging the Structure of DNAJA1 to Discover Novel Pancreatic Cancer Therapies
分子名称: Isoform 2 of DnaJ homolog subfamily A member 1
著者Roth, H.E, Powers, R.
登録日2022-08-15
公開日2022-11-09
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Leveraging the Structure of DNAJA1 to Discover Novel Potential Pancreatic Cancer Therapies.
Biomolecules, 12, 2022
6GCJ
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BU of 6gcj by Molmil
Solution structure of the RodA hydrophobin from Aspergillus fumigatus
分子名称: Hydrophobin
著者Pille, A, Kwan, A, Aimanianda, V, Latge, J.-P, Sunde, M, Guijarro, J.I.
登録日2018-04-18
公開日2019-03-27
最終更新日2019-09-04
実験手法SOLUTION NMR
主引用文献Assembly and disassembly of Aspergillus fumigatus conidial rodlets
Cell Surf, 2019
7RNO
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BU of 7rno by Molmil
Model of the Ac-6-FP/hpMR1/bB2m/TAPBPR complex from integrated docking, NMR and restrained MD
分子名称: Beta-2-microglobulin, Major histocompatibility complex class I-related gene protein, N-(6-formyl-4-oxo-3,4-dihydropteridin-2-yl)acetamide, ...
著者McShan, A.C, Sgourakis, N.G.
登録日2021-07-29
公開日2022-05-11
最終更新日2022-08-10
実験手法SOLUTION NMR
主引用文献TAPBPR employs a ligand-independent docking mechanism to chaperone MR1 molecules.
Nat.Chem.Biol., 18, 2022
2FNF
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BU of 2fnf by Molmil
C1 domain of Nore1
分子名称: ZINC ION, putative Ras Effector Nore1
著者Harjes, E, Harjes, S, Wohlgemuth, S, Krieger, E, Herrmann, C, Muller, K.H, Bayer, P.
登録日2006-01-11
公開日2006-02-07
最終更新日2024-05-29
実験手法SOLUTION NMR
主引用文献GTP-Ras disrupts the intramolecular complex of C1 and RA domains of Nore1.
Structure, 14, 2006

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