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Ligand · 3WD

3WD · 2-methyl-L-alanyl-N-[(3R,4S,5S)-3-methoxy-1-{(2S)-2-[(1R,2R)-1-methoxy-2-methyl-3-oxo-3-{[(1S)-2-phenyl-1-(1,3-thiazol-2-yl)ethyl]amino}propyl]pyrrolidin-1-yl}-5-methyl-1-oxoheptan-4-yl]-N-methyl-L-valinamide

3WD, 2-methyl-L-alanyl-N-[(3R,4S,5S)-3-methoxy-1-{(2S)-2-[(1R,2R)-1-methoxy-2-methyl-3-oxo-3-{[(1S)-2-phenyl-1-(1,3-thiazol-2-yl)ethyl]amino}propyl]pyrrolidin-1-yl}-5-methyl-1-oxoheptan-4-yl]-N-methyl-L-valinamide (C39 H62 N6 O6 S, 743.0…

Component
3WD
Formula
C39 H62 N6 O6 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

3WD in 2 structures; the first of them:

  • 4X1I · Discovery of cytotoxic Dolastatin 10 analogs with N-terminal modifications · 3WD B503 · binds GLN11, GLN15, LYS176, VAL177, SER178, ASP179, THR221, PRO222 and 13 more
  • 4X1I · Discovery of cytotoxic dolastatin 10 analogs with N-terminal modifications · 3WD B503 · binds GLN11, GLN15, LYS176, VAL177, SER178, ASP179, THR221, PRO222 and 13 more

Residues it binds most

GLN 4, PRO 4, THR 4, VAL 4, ASN 4, TYR 4, ARG 4, ASP 4, GLY 4, ILE 2 (residue and the binding sites it lines).

Found with

  • GDP · Guanosine-5'-diphosphate
  • GTP · Guanosine-5'-triphosphate
  • LOC · N-[(7S)-1,2,3,10-tetramethoxy-9-oxo-6,7-dihydro-5H-benzo[d]heptalen-7-yl]ethanamide
  • MG · Magnesium ion

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