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Ligand · 1NQ

1NQ · N-{2-[1-(6-carbamoylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]ethyl}-N'-ethylthiophene-2,5-dicarboxamide

1NQ, N-{2-[1-(6-carbamoylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-yl]ethyl}-N'-ethylthiophene-2,5-dicarboxamide (C22 H26 N6 O3 S2, 486.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
1NQ
Formula
C22 H26 N6 O3 S2
Class
ligand
Structures
2
PDB entries
1

Binding sites

1NQ in 2 structures; the first of them:

  • 4JSR · Crystal Structure of human SIRT3 with ELT inhibitor 11c… · 1NQ A402 · binds ALA146, SER149, ILE154, ASP156, PHE157, ARG158, TYR165, PHE180 and 13 more
  • 4JSR · Crystal structure of human SIRT3 with elt inhibitor 11C [N-{2-[1-(6… · 1NQ A402 · binds ALA146, SER149, ILE154, ASP156, PHE157, ARG158, TYR165, PHE180 and 13 more

Residues it binds most

PHE 2, ILE 2, ASP 2, PRO 2, ALA 2, ARG 2, ASN 2, GLN 2, GLU 2, HIS 2 (residue and the binding sites it lines).

Found with

  • ZN · Zinc ion

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