GL1X · GenesisL1 explorer

Ligand · A9F

A9F · N-{[3-({[(1R,2S)-2-{[(2E)-2-cyano-4,4-dimethylpent-2-enoyl]amino}cyclopentyl]oxy}methyl)phenyl]methyl}-4-[(4-methylpiperazin-1-yl)methyl]benzamide

A9F, N-{[3-({[(1R,2S)-2-{[(2E)-2-cyano-4,4-dimethylpent-2-enoyl]amino}cyclopentyl]oxy}methyl)phenyl]methyl}-4-[(4-methylpiperazin-1-yl)methyl]benzamide (C34 H45 N5 O3, 571.8 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record…

Component
A9F
Formula
C34 H45 N5 O3
Class
ligand
Structures
1
PDB entries
1

Binding sites

A9F in 1 structure; the first of them:

  • 6IJS · Human ppargamma ligand binding domain complexed with SB1494 · A9F A501 · binds PHE226, ALA278, ILE281, PHE282, CYS285, GLN286, ARG288, SER289 and 15 more

Residues it binds most

LEU 1, PHE 1, ILE 1, MET 1, ALA 1, TYR 1, ARG 1, CYS 1, GLN 1, HIS 1 (residue and the binding sites it lines).

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