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Ligand · 3WY

3WY · 2-methyl-L-prolyl-N-[(3R,4S,5S)-1-{(2S)-2-[(1R,2R)-3-{[(1S)-1-carboxy-2-phenylethyl]amino}-1-methoxy-2-methyl-3-oxopropyl]pyrrolidin-1-yl}-3-methoxy-5-methyl-1-oxoheptan-4-yl]-N-methyl-L-valinamide

3WY, 2-methyl-L-prolyl-N-[(3R,4S,5S)-1-{(2S)-2-[(1R,2R)-3-{[(1S)-1-carboxy-2-phenylethyl]amino}-1-methoxy-2-methyl-3-oxopropyl]pyrrolidin-1-yl}-3-methoxy-5-methyl-1-oxoheptan-4-yl]-N-methyl-L-valinamide (C39 H63 N5 O8, 730.0 g/mol), in the…

Component
3WY
Formula
C39 H63 N5 O8
Class
ligand
Structures
2
PDB entries
1

Binding sites

3WY in 2 structures; the first of them:

  • 4X20 · Discovery of cytotoxic Dolastatin 10 analogs with N-terminal modifications · 3WY B503 · binds GLN11, GLN15, PRO175, LYS176, VAL177, SER178, ASP179, TYR210 and 15 more
  • 4X20 · Discovery of cytotoxic dolastatin 10 analogs with N-terminal modifications · 3WY B503 · binds GLN11, GLN15, PRO175, LYS176, VAL177, SER178, ASP179, TYR210 and 15 more

Residues it binds most

PRO 4, ASN 4, GLN 4, TYR 4, VAL 4, THR 4, ARG 4, ASP 4, GLY 4, LYS 4 (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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