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Ligand · 57K

57K · tert-butyl 7-[(7-methyl-1H-indazol-5-yl)carbonyl]-2,7-diazaspiro[3.5]nonane-2-carboxylate

57K, tert-butyl 7-[(7-methyl-1H-indazol-5-yl)carbonyl]-2,7-diazaspiro[3.5]nonane-2-carboxylate (C21 H28 N4 O3, 384.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
57K
Formula
C21 H28 N4 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

57K in 2 structures; the first of them:

  • 5CTC · Humanized yeast ACC carboxyltransferase domain bound to tert-butyl… · 57K A2301 · binds ALA1920, VAL1923, PHE1925, ARG1954, PHE1956, SER1957, GLY1958, LEU2025 and 5 more
  • 5CTC · Humanized yeast acc carboxyltransferase domain bound to tert-butyl 7… · 57K A2301 · binds ALA1920, VAL1923, PHE1925, ARG1954, PHE1956, SER1957, GLY1958, LEU2025 and 5 more

Residues it binds most

GLU 6, LEU 6, GLY 6, PHE 6, ALA 6, VAL 6, ARG 6, SER 6, ILE 4, LYS 4 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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