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Ligand · L88

L88 · (4R,22R)-5,21-dioxo-4,22-bis({3-[4-(4-phenylthiophen-2-yl)phenyl]propanoyl}amino)-10,13,16-trioxa-6,20-diazapentacosane-1,25-dioic acid

L88, (4R,22R)-5,21-dioxo-4,22-bis({3-[4-(4-phenylthiophen-2-yl)phenyl]propanoyl}amino)-10,13,16-trioxa-6,20-diazapentacosane-1,25-dioic acid (C58 H66 N4 O11 S2, 1059.3 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1…

Component
L88
Formula
C58 H66 N4 O11 S2
Class
ligand
Structures
2
PDB entries
1

Binding sites

L88 in 2 structures; the first of them:

  • 4I03 · Human MMP12 in complex with a PEG-linked bifunctional L-glutamate motif inhibitor · L88 A306 · binds ASP175, GLY179, ILE180, LEU181, ALA182, HIS183, LEU214, THR215 and 13 more
  • 4I03 · Human MMP12 in complex with a peg-linked bifunctional L-glutamate motif inhibitor · L88 A306 · binds ASP175, GLY179, ILE180, LEU181, ALA182, HIS183, LEU214, THR215 and 13 more

Residues it binds most

HIS 2, ALA 2, LEU 2, LYS 2, PRO 2, THR 2, VAL 2, ASP 2, GLY 2, ILE 2 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • ZN · Zinc ion
  • DMS · Dimethyl sulfoxide
  • EDO · 1,2-ethanediol
  • GOL · Glycerol
  • PEG · Di(hydroxyethyl)ether
  • PGO · S-1,2-propanediol

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