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Structure paper

TitleBenziodarone and 6-hydroxybenziodarone are potent and selective inhibitors of transthyretin amyloidogenesis.
Journal, issue, pagesBioorg. Med. Chem., Vol. 90, Page 117370-117370, Year 2023
Publish dateFeb 24, 2023 (structure data deposition date)
AuthorsMizuguchi, M. / Yokoyama, T. / Okada, T. / Nakagawa, Y. / Fujii, K. / Nabeshima, Y. / Toyooka, N.
External linksBioorg. Med. Chem. / PubMed:37311373
MethodsX-ray diffraction
Resolution1.399 - 1.907 Å
Structure data

PDB-8ii1:
Crystal structure of V30M-TTR in complex with BID
Method: X-RAY DIFFRACTION / Resolution: 1.907 Å

PDB-8ii2:
Crystal structure of V30M-TTR in complex with BBM
Method: X-RAY DIFFRACTION / Resolution: 1.798 Å

PDB-8ii3:
Crystal structure of V30M-TTR in complex with 6-hydroxy BID
Method: X-RAY DIFFRACTION / Resolution: 1.399 Å

PDB-8ii4:
Crystal structure of V30M-TTR in complex with 6-hydroxy BBM
Method: X-RAY DIFFRACTION / Resolution: 1.499 Å

Chemicals

ChemComp-PJO:
Benziodarone

ChemComp-HOH:
WATER

ChemComp-R75:
[3,5-bis(bromanyl)-4-oxidanyl-phenyl]-(2-ethyl-1-benzofuran-3-yl)methanone / antiarrhythmic, inhibitor*YM

ChemComp-CA:
Unknown entry

ChemComp-PKK:
[3,5-bis(iodanyl)-4-oxidanyl-phenyl]-(2-ethyl-6-oxidanyl-1-benzofuran-3-yl)methanone

ChemComp-PKQ:
[3,5-bis(bromanyl)-4-oxidanyl-phenyl]-(2-ethyl-6-oxidanyl-1-benzofuran-3-yl)methanone

Source
  • homo sapiens (human)
KeywordsTRANSPORT PROTEIN / thyroxine / amyloidosis / inhibitor

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