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Ligand · FP8

FP8 · (1R,2S)-1-hydroxy-2-[(N-{[(2-methyl-2-azaspiro[3.3]heptan-6-yl)oxy]carbonyl}-L-leucyl) amino]-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid

FP8, (1R,2S)-1-hydroxy-2-[(N-{[(2-methyl-2-azaspiro[3.3]heptan-6-yl)oxy]carbonyl}-L-leucyl) amino]-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid (C28 H40 N4 O9 S, 608.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2…

Component
FP8
Formula
C28 H40 N4 O9 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

FP8 in 2 structures; the first of them:

  • 7T43 · Structure of SARS-CoV-2 3CL protease in complex with inhibitor 3c · FP8 A502 · binds HIS41, MET49, TYR54, PHE140, LEU141, ASN142, SER144, CYS145 and 11 more
  • 7T43 · Structure of SARS-cov-2 3CL protease in complex with inhibitor 3C · FP8 A502 · binds HIS41, MET49, TYR54, PHE140, LEU141, ASN142, SER144, CYS145 and 11 more

Residues it binds most

HIS 4, LEU 4, MET 4, ARG 4, ASN 4, ASP 4, CYS 4, GLN 4, GLU 4, PHE 4 (residue and the binding sites it lines).

Found with

  • FN2 · (1S,2S)-1-hydroxy-2-[(N-{[(2-methyl-2-azaspiro[3.3]heptan-6-yl)oxy]carbonyl}-L-leucyl) amino]-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid
  • PG4 · Tetraethylene glycol

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