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Ligand · S8N

S8N · (2~{R},5~{S},12~{R})-12-cyclohexyl-2-[2-(3,4-dimethoxyphenyl)ethyl]-15,15,16-trimethyl-3,19-dioxa-10,13,16-triazatricyclo[18.3.1.0^{5,10}]tetracosa-1(24),20,22-triene-4,11,14,17-tetrone

S8N, (2~{R},5~{S},12~{R})-12-cyclohexyl-2-[2-(3,4-dimethoxyphenyl)ethyl]-15,15,16-trimethyl-3,19-dioxa-10,13,16-triazatricyclo[18.3.1.0^{5,10}]tetracosa-1(24),20,22-triene-4,11,14,17-tetrone (C38 H51 N3 O8, 677.8 g/mol), in the MolNFT…

Component
S8N
Formula
C38 H51 N3 O8
Class
ligand
Structures
3
PDB entries
2

Binding sites

S8N in 3 structures; the first of them:

  • 7AWF · The Fk1 domain of FKBP51 in complex with (2R,5S,12R)-12-cyclohexyl-2-[2-(3,4-dimethoxyphen… · S8N A201 · binds TYR57, GLY59, LYS60, LEU61, ASP68, SER70, HIS71, PHE77 and 11 more
  • 8BA6 · Structure of the FK1 domain of the FKBP51 G64S variant in complex with… · S8N A201 · binds TYR57, GLY59, LYS60, LEU61, ASP68, SER70, HIS71, PHE77 and 11 more
  • 7AWF · The FK1 domain of FKBP51 in complex with (2R,5S,12R)-12-cyclohexyl-2… · S8N A201 · binds TYR57, GLY59, LYS60, LEU61, ASP68, SER70, HIS71, PHE77 and 11 more

Residues it binds most

GLY 3, ILE 3, LEU 3, LYS 3, PHE 3, TYR 3, ALA 3, ASP 3, GLN 3, HIS 3 (residue and the binding sites it lines).

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