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Ligand · 2YS

2YS · D-valyl-N-[(2S,3S)-7-amino-1-chloro-2-hydroxyheptan-3-yl]-L-leucinamide

2YS, D-valyl-N-[(2S,3S)-7-amino-1-chloro-2-hydroxyheptan-3-yl]-L-leucinamide (C18 H37 Cl N4 O3, 393.0 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the…

Component
2YS
Formula
C18 H37 Cl N4 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

2YS in 2 structures; the first of them:

  • 4Q80 · Neutrophil serine protease 4 (PRSS57) with val-leu-lys-chloromethylketone (VLK-cmk) · 2YS A304 · binds CYS42, HIS57, TYR94, HIS99, ASP102, PHE190, CYS191, SER192 and 10 more
  • 4Q80 · Neutrophil serine protease 4 (PRSS57) with val-leu-lys- chloromethylketone (vlk-cmk) · 2YS A304 · binds CYS42, HIS57, TYR94, HIS99, ASP102, PHE190, CYS191, SER192 and 10 more

Residues it binds most

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

Found with

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose

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