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Ligand · TDT

TDT · 1-azepan-1-yl-2-phenyl-2-(4-thioxo-1,4-dihydro-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone adduct

TDT, 1-azepan-1-yl-2-phenyl-2-(4-thioxo-1,4-dihydro-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone adduct (C40 H44 N12 O15 P2 S -4, 1026.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
TDT
Formula
C40 H44 N12 O15 P2 S -4
Class
ligand
Structures
2
PDB entries
1

Binding sites

TDT in 2 structures; the first of them:

  • 1U7T · Crystal Structure of ABAD/HSD10 with a Bound Inhibitor · TDT A501 · binds GLY17, ALA19, SER20, GLY21, LEU22, GLY23, ASP41, LEU42 and 31 more
  • 1U7T · Crystal structure of ABAD/HSD10 with a bound inhibitor · TDT A501 · binds GLY17, ALA19, SER20, GLY21, LEU22, GLY23, ASP41, LEU42 and 31 more

Residues it binds most

LEU 6, ALA 6, GLY 6, VAL 6, SER 6, THR 6, ASP 6, GLN 6, PRO 6, CYS 6 (residue and the binding sites it lines).

Found with

  • NAD · Nicotinamide-adenine-dinucleotide

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