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TitleArtificial intelligence and first-principle methods in protein redesign: A marriage of convenience?
Journal, issue, pagesProtein Sci., Vol. 34, Page e70210-e70210, Year 2025
Publish dateApr 9, 2024 (structure data deposition date)
AuthorsCianferoni, D. / Vizarraga, D. / Fernandez-Escamilla, A.M. / Fita, I. / Hamdani, R. / Reche, R. / Delgado, J. / Serrano, L.
External linksProtein Sci. / PubMed:40671352
MethodsX-ray diffraction
Resolution1.013 - 1.34 Å
Structure data

PDB-9eyb:
A-SPECTRIN SH3 DOMAIN V9L, A11V, V23L, M25C, V46W, V53L and V58L MUTANT
Method: X-RAY DIFFRACTION / Resolution: 1.337 Å

PDB-9eyc:
A-SPECTRIN SH3 DOMAIN V9L, A11V, V23L, M25C, V46W, V53L and V58L MUTANT
Method: X-RAY DIFFRACTION / Resolution: 1.06 Å

PDB-9eye:
A-SPECTRIN SH3 DOMAIN V9L, A11V, L31V, V44I, V53I MUTANT
Method: X-RAY DIFFRACTION / Resolution: 1.13 Å

PDB-9eyf:
A-SPECTRIN SH3 DOMAIN V9L, A11V, V23L, M25L, V46Y, V53I MUTANT
Method: X-RAY DIFFRACTION / Resolution: 1.34 Å

PDB-9ih6:
A-SPECTRIN SH3 DOMAIN V9Y, A11V, V23L, M25V, V53L, V58L MUTANT
Method: X-RAY DIFFRACTION / Resolution: 1.31 Å

PDB-9ih7:
A-SPECTRIN SH3 DOMAIN V9L, A11V, V23I, M25V, V46F, V53L, V58L MUTANT
Method: X-RAY DIFFRACTION / Resolution: 1.12 Å

PDB-9iha:
A-SPECTRIN SH3 DOMAIN V9L, A11V, M25V, V46F, V58L MUTANT
Method: X-RAY DIFFRACTION / Resolution: 1.013 Å

Chemicals

ChemComp-GOL:
GLYCEROL

ChemComp-PO4:
PHOSPHATE ION

ChemComp-HOH:
WATER

ChemComp-SO4:
SULFATE ION

Source
  • gallus gallus (chicken)
KeywordsSIGNALING PROTEIN / Three-dimensional structure / SH3 domain / Cell signaling / Src-family / Hydrophobic-core mutations / STRUCTURAL PROTEIN

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