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Ligand · 7TX

7TX · 5-[[2,4-bis(oxidanylidene)quinazolin-1-yl]methyl]-2-fluoranyl-N-[(3R)-1-(3-methylbutyl)pyrrolidin-3-yl]benzamide

7TX, 5-[[2,4-bis(oxidanylidene)quinazolin-1-yl]methyl]-2-fluoranyl-N-[(3R)-1-(3-methylbutyl)pyrrolidin-3-yl]benzamide (C25 H29 F N4 O3, 452.5 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every binding…

Component
7TX
Formula
C25 H29 F N4 O3
Class
ligand
Structures
1
PDB entries
1

Binding sites

7TX in 1 structure; the first of them:

  • 5WRQ · Structure of human PARP1 catalytic domain bound to a quinazoline-2, 4(1H,3H)-dione… · 7TX A1101 · binds TYR710, ASP766, LEU769, HIS862, GLY863, ARG878, TYR889, GLY894 and 7 more

Residues it binds most

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

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