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Ligand · B38

B38 · 1'-(1H-indazol-7-ylcarbonyl)-6-methylspiro[chromene-2,4'-piperidin]-4(3H)-one

B38, 1'-(1H-indazol-7-ylcarbonyl)-6-methylspiro[chromene-2,4'-piperidin]-4(3H)-one (C22 H21 N3 O3, 375.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å…

Component
B38
Formula
C22 H21 N3 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

B38 in 2 structures; the first of them:

  • 3H0S · Crystal structure of the carboxyltransferase domain of acetyl-coenzyme A carboxylase in… · B38 A101 · binds PRO1920, VAL1923, ARG1954, GLY1955, PHE1956, SER1957, GLY1958, LEU2025 and 3 more
  • 3H0S · Crystal structure of the carboxyltransferase domain of acetyl-coenzyme a carboxylase in… · B38 A101 · binds PRO1920, VAL1923, ARG1954, GLY1955, PHE1956, SER1957, GLY1958, LEU2025 and 3 more

Residues it binds most

GLY 6, ARG 6, VAL 6, GLN 6, GLU 6, LEU 6, PHE 6, PRO 6, SER 6, ALA 4 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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