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Ligand · S89

S89 · N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-Nalpha-[(2E)-3-phenylprop-2-enoyl]-L-phenylalaninamide

S89, N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-Nalpha-[(2E)-3-phenylprop-2-enoyl]-L-phenylalaninamide (C27 H28 N2 O3, 428.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues…

Component
S89
Formula
C27 H28 N2 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

S89 in 2 structures; the first of them:

  • 3SN8 · Crystal structure of SARS coronavirus main protease complexed with Cm-FF-H (soaking) · S89 A307 · binds HIS41, MET49, PHE140, LEU141, ASN142, GLY143, SER144, CYS145 and 9 more
  • 3SN8 · Crystal structure of SARS coronavirus main protease complexed with cm- ff-H (soaking) · S89 A307 · binds HIS41, MET49, PHE140, LEU141, ASN142, GLY143, SER144, CYS145 and 9 more

Residues it binds most

HIS 2, LEU 2, MET 2, ARG 2, ASN 2, ASP 2, CYS 2, GLN 2, GLU 2, GLY 2 (residue and the binding sites it lines).

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