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Ligand · 151

151 · (2S)-3-methyl-2-((2R,3S)-3-[(methylsulfonyl)amino]-1-{[2-(pyrrolidin-1-ylmethyl)-1,3-oxazol-4-yl]carbonyl}pyrrolidin-2-yl)butanoic acid

151, (2S)-3-methyl-2-((2R,3S)-3-[(methylsulfonyl)amino]-1-{[2-(pyrrolidin-1-ylmethyl)-1,3-oxazol-4-yl]carbonyl}pyrrolidin-2-yl)butanoic acid (C19 H30 N4 O6 S, 442.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB…

Component
151
Formula
C19 H30 N4 O6 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

151 in 2 structures; the first of them:

  • 1H1B · Crystal structure of human neutrophil elastase complexed with an inhibitor (GW475151) · 151 A400 · binds HIS57, ASN99A, LEU99B, VAL190, CYS191, PHE192, GLY193, ASP194 and 4 more
  • 1H1B · Crystal structure of human neutrophil elastase complexed with an inhibitor (GW475151) · 151 A400 · binds HIS57, ASN99A, LEU99B, VAL190, CYS191, PHE192, GLY193, ASP194 and 4 more

Residues it binds most

PHE 4, SER 4, VAL 4, ASN 4, ASP 4, CYS 4, GLY 4, HIS 4, LEU 4, ALA 2 (residue and the binding sites it lines).

Found with

  • FUC · alpha-L-fucopyranose
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose

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