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Ligand · WEW

WEW · (3~{R})-1-[[4-[2-chloranyl-3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenyl]-2-methoxy-phenyl]methyl]-~{N}-(2-hydroxyethyl)pyrrolidine-3-carboxamide

WEW, (3~{R})-1-[[4-[2-chloranyl-3-(2,3-dihydro-1,4-benzodioxin-6-yl)phenyl]-2-methoxy-phenyl]methyl]-~{N}-(2-hydroxyethyl)pyrrolidine-3-carboxamide (C29 H31 Cl N2 O5, 523.0 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records…

Component
WEW
Formula
C29 H31 Cl N2 O5
Class
ligand
Structures
2
PDB entries
2

Binding sites

WEW in 2 structures; the first of them:

  • 8P1O · Solubilizer tag effect on PD-L1/inhibitor binding properties for m-terphenyl derivatives · WEW A201 · binds ILE53, TYR55, GLN65, MET114, ILE115, SER116, ALA120, ASP121 and 11 more
  • 8R6Q · Co-crystal structure of PD-L1 with low molecular weight inhibitor · WEW A201 · binds ILE53, TYR55, GLN65, MET114, ILE115, SER116, ALA120, ASP121 and 11 more

Residues it binds most

ILE 2, TYR 2, ALA 2, ASP 2, MET 2, SER 2, ARG 2, GLN 2, LYS 2 (residue and the binding sites it lines).

Found with

  • CL · Chloride ion
  • SO4 · Sulfate ion

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