| Naslov: | Comparative simulative analysis and design of single-chain self-assembled protein cages |
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| Avtorji: | ID Xiao, Fei (Avtor)
ID Luo, Longfei (Avtor)
ID Liu, Xin (Avtor)
ID Ljubetič, Ajasja (Avtor)
ID Jin, Nengzhi (Avtor)
ID Jerala, Roman (Avtor)
ID Hu, Guang (Avtor) |
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| Datoteke: |  URL - Izvorni URL, za dostop obiščite https://pubs.acs.org/doi/full/10.1021/acs.jpcb.4c01957
 PDF - Predstavitvena datoteka. (2,23 MB, Vsebina dokumenta nedostopna do 04.07.2025)
MD5: 54C6D70FBEC5796B7BC08A1BABDED5DB
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| Jezik: | Angleški jezik |
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| Tipologija: | 1.01 - Izvirni znanstveni članek |
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| Organizacija: |  KI - Kemijski inštitut
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| Povzetek: | Coiled-coil protein origami (CCPO) is a modular strategy for the de novo design of polypeptide nanostructures. It represents a type of modular design based on pairwise-interacting coiled-coil (CC) units with a single-chain protein programmed to fold into a polyhedral cage. However, the mechanisms underlying the self-assembly of the protein tetrahedron are still not fully understood. In the present study, 18 CCPO cages with three different topologies were modeled in silico. Then, molecular dynamics simulations and CC parameters were calculated to characterize the dynamic properties of protein tetrahedral cages at both the local and global levels. Furthermore, a deformed CC unit was redesigned, and the stability of the new cage was significantly improved. |
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| Ključne besede: | chemical structure, conformation, genetics oligomers stability |
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| Status publikacije: | Objavljeno |
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| Verzija publikacije: | Recenzirani rokopis |
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| Datum objave: | 01.01.2024 |
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| Založnik: | American Chemical Society |
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| Leto izida: | 2024 |
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| Št. strani: | str. 6272-6282 |
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| Številčenje: | Vol. 128, iss. 26 |
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| Izvor: | The Journal of Physical Chemistry B |
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| PID: | 20.500.12556/DiRROS-20507  |
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| UDK: | 577 |
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| ISSN pri članku: | 1520-5207 |
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| DOI: | 10.1021/acs.jpcb.4c01957 |
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| COBISS.SI-ID: | 208525059 |
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| Avtorske pravice: | © 2024 American Chemical Society |
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| Opomba: | Nasl. z nasl. zaslona;
Opis vira z dne 23. 9. 2024 ;
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| Datum objave v DiRROS: | 03.10.2024 |
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| Število ogledov: | 188 |
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| Število prenosov: | 50 |
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| Metapodatki: |    |
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