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Ligand · YKT

YKT · (1'S,3aS,5R,16R,17S,19Z,21R,21aR)-6'-chloro-20-fluoro-21-{[(5S,9aS)-hexahydropyrazino[2,1-c][1,4]oxazin-8(1H)-yl]methyl}-21-methoxy-16,17-dimethyl-2,3,3',3a,4',16,17,18,21,21a-decahydro-2'H,6H,8H-15lambda~6~-spiro[10,12-(ethanediylidene)-15lambda~6~-furo[3,2-i][1,4]oxazepino[3,4-f][1,2,7]thiadiazacyclohexadecine-7,1'-naphthalene]-13,15,15(4H,14H)-trione

YKT, (1'S,3aS,5R,16R,17S,19Z,21R,21aR)-6'-chloro-20-fluoro-21-{[(5S,9aS)-hexahydropyrazino[2,1-c][1,4]oxazin-8(1H)-yl]methyl}-21-methoxy-16,17-dimethyl-2,3,3',3a,4',16,17,18,21,21a-decahydro-2'H,6H,8H-15lambda~6~-spiro[10,12-(ethanediyliden…

Component
YKT
Formula
C41 H54 Cl F N4 O7 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

YKT in 1 structure; the first of them:

  • 8G3U · MBP-Mcl1 in complex with ligand 21 · YKT A503 · binds HIS224, ALA227, PHE228, MET231, LYS234, LEU235, LEU246, VAL249 and 12 more

Residues it binds most

LEU 1, PHE 1, VAL 1, GLY 1, MET 1, ALA 1, ARG 1, HIS 1, ILE 1, LYS 1 (residue and the binding sites it lines).

Found with

  • GLC · alpha-D-glucopyranose
  • EDO · 1,2-ethanediol

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