Ligand · 0QA
0QA · 4-[methyl(nitroso)amino]-1-(pyridin-3-yl)butan-1-one
0QA, 4-[methyl(nitroso)amino]-1-(pyridin-3-yl)butan-1-one (C10 H13 N3 O2, 207.2 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds…
- Component
- 0QA
- Formula
- C10 H13 N3 O2
- Class
- ligand
- Structures
- 4
- PDB entries
- 2
Binding sites
0QA in 4 structures; the first of them:
- 4EJH · Human Cytochrome P450 2A13 in complex with 4-(methylnitrosamino)-1-(3-pyridyl)-1-buta… · 0QA A502 · binds PHE107, PHE111, ALA117, PHE118, PHE209, LEU296, ASN297, PHE300 and 5 more
- 4EJI · Human Cytochrome P450 2A13 in complex with two molecules of… · 0QA A502 · binds ARG76, GLU103, GLN104, PHE107, PHE209, THR212, GLU221, PHE300 and 8 more
- 4EJH · Human cytochrome P450 2A13 in complex with 4-(methylnitrosamino)-1-(3… · 0QA A502 · binds PHE107, PHE111, ALA117, PHE118, PHE209, LEU296, ASN297, PHE300 and 5 more
- 4EJI · Human cytochrome P450 2A13 in complex with two molecules of 4… · 0QA A502 · binds ARG76, GLU103, GLN104, PHE107, PHE209, THR212, GLU221, PHE300 and 8 more
Residues it binds most
PHE 16, LEU 16, ALA 16, THR 16, ASN 14, CYS 10, GLU 2, ARG 2, GLN 2, GLY 2 (residue and the binding sites it lines).
Found with
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