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Ligand · 7F1

7F1 · (2S)-N-[(E,2S)-1-(1H-indol-3-yl)-4-methylsulfonyl-but-3-en-2-yl]-2-[[(2S)-3-(1H-indol-3-yl)-2-(2-morpholin-4-ylethanoylamino)propanoyl]amino]-4-methyl-pentanamide

7F1, (2S)-N-[(E,2S)-1-(1H-indol-3-yl)-4-methylsulfonyl-but-3-en-2-yl]-2-[[(2S)-3-(1H-indol-3-yl)-2-(2-morpholin-4-ylethanoylamino)propanoyl]amino]-4-methyl-pentanamide (C36 H46 N6 O6 S, 690.9 g/mol), in the MolNFT structures on GenesisL1…

Component
7F1
Formula
C36 H46 N6 O6 S
Class
ligand
Structures
2
PDB entries
2

Binding sites

7F1 in 2 structures; the first of them:

  • 5FMG · Structure and function based design of Plasmodium-selective proteasome inhibitors · 7F1 I300 · binds THR1, ALA20, THR21, GLU22, ALA27, CYS31, SER32, LYS33 and 17 more
  • 8G6F · Structure of the Plasmodium falciparum 20S proteasome beta-6 A117D mutant complexed with… · 7F1 I301 · binds THR1, ARG19, ALA20, THR21, GLU22, ALA27, CYS31, SER32 and 20 more

Residues it binds most

ALA 6, GLY 6, SER 6, GLU 6, LEU 6, LYS 6, THR 6, CYS 4, ARG 4, ASP 6 (residue and the binding sites it lines).

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