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Ligand · KDW

KDW · ~{N}-[2-[[4-[[3-[3-[[4-[(2-acetamidoethylamino)methyl]-5-[(5-cyanopyridin-3-yl)methoxy]-2-methyl-phenoxy]methyl]-2-methyl-phenyl]-2-methyl-phenyl]methoxy]-2-[(5-cyanopyridin-3-yl)methoxy]-5-methyl-phenyl]methylamino]ethyl]ethanamide

KDW, ~{N}-[2-[[4-[[3-[3-[[4-[(2-acetamidoethylamino)methyl]-5-[(5-cyanopyridin-3-yl)methoxy]-2-methyl-phenoxy]methyl]-2-methyl-phenyl]-2-methyl-phenyl]methoxy]-2-[(5-cyanopyridin-3-yl)methoxy]-5-methyl-phenyl]methylamino]ethyl]ethanamide…

Component
KDW
Formula
C54 H58 N8 O6
Class
ligand
Structures
2
PDB entries
1

Binding sites

KDW in 2 structures; the first of them:

  • 6RPG · Structure of human Programmed cell death 1 ligand 1 (PD-L1) with inhibitor · KDW B201 · binds ALA18, PHE19, THR20, ILE54, TYR56, GLU58, ASP61, ASN63 and 27 more
  • 6RPG · Structure of human programmed cell death 1 ligand 1 (pd-L1) with inhibitor · KDW B201 · binds PHE19, THR20, ILE54, TYR56, ASP61, GLN66, VAL68, MET115 and 21 more

Residues it binds most

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

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