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Ligand · M00

M00 · N-[(2S)-1-hydroxybutan-2-yl]-3-(4-oxo-3,4-dihydroquinazolin-2-yl)propanamide

M00, N-[(2S)-1-hydroxybutan-2-yl]-3-(4-oxo-3,4-dihydroquinazolin-2-yl)propanamide (C15 H19 N3 O3, 289.3 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, the…

Component
M00
Formula
C15 H19 N3 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

M00 in 2 structures; the first of them:

  • 4L7R · Human artd3 (parp3) - catalytic domain in complex with inhibitor ME0400 · M00 A601 · binds ASP284, LEU287, VAL288, ASP291, TRP383, HIS384, GLY385, THR386 and 8 more
  • 4L7R · Human ARTD3 (PARP3) - catalytic domain in complex with inhibitor ME0400 · M00 A601 · binds ASP284, LEU287, VAL288, ASP291, TRP383, HIS384, GLY385, THR386 and 8 more

Residues it binds most

ASP 2, TYR 2, VAL 2, ALA 2, GLU 2, GLY 2, HIS 2, LEU 2, LYS 2, PHE 2 (residue and the binding sites it lines).

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