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TitleGeneralized biomolecular modeling and design with RoseTTAFold All-Atom.
Journal, issue, pagesScience, Vol. 384, Page eadl2528-eadl2528, Year 2024
Publish dateDec 13, 2023 (structure data deposition date)
AuthorsKrishna, R. / Wang, J. / Ahern, W. / Sturmfels, P. / Venkatesh, P. / Kalvet, I. / Lee, G.R. / Morey-Burrows, F.S. / Anishchenko, I. / Humphreys, I.R. ...Krishna, R. / Wang, J. / Ahern, W. / Sturmfels, P. / Venkatesh, P. / Kalvet, I. / Lee, G.R. / Morey-Burrows, F.S. / Anishchenko, I. / Humphreys, I.R. / McHugh, R. / Vafeados, D. / Li, X. / Sutherland, G.A. / Hitchcock, A. / Hunter, C.N. / Kang, A. / Brackenbrough, E. / Bera, A.K. / Baek, M. / DiMaio, F. / Baker, D.
External linksScience / PubMed:38452047
MethodsX-ray diffraction
Resolution1.8 Å
Structure data

PDB-8vc8:
Crystal structure of heme-loaded design: HEM_3.C9
Method: X-RAY DIFFRACTION / Resolution: 1.8 Å

Chemicals

ChemComp-SO4:
SULFATE ION

ChemComp-HEM:
PROTOPORPHYRIN IX CONTAINING FE

ChemComp-HOH:
WATER

Source
  • synthetic construct (others)
KeywordsDE NOVO PROTEIN / de novo design / RFdiffusion / AlphaFold2 / RoseTTAFold

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