Ligand · A8R
A8R · (2S)-2-{5-[(5-{[(1S)-1-(4-tert-butylphenyl)ethyl]carbamoyl}-2,3-dimethyl-1H-indol-1-yl)methyl]-2-chlorophenoxy}propanoic acid
A8R, (2S)-2-{5-[(5-{[(1S)-1-(4-tert-butylphenyl)ethyl]carbamoyl}-2,3-dimethyl-1H-indol-1-yl)methyl]-2-chlorophenoxy}propanoic acid (C33 H37 Cl N2 O4, 561.1 g/mol), in the MolNFT structures on GenesisL1: bound in 3 records (3 PDB entries).…
- Component
- A8R
- Formula
- C33 H37 Cl N2 O4
- Class
- ligand
- Structures
- 3
- PDB entries
- 3
Binding sites
A8R in 3 structures; the first of them:
- 7SQA · PPAR gamma LBD bound to SR10221 and SMRT corepressor motif · A8R A501 · binds PHE264, ILE281, PHE282, GLY284, CYS285, GLN286, ARG288, SER289 and 19 more
- 7SQB · PPAR gamma LBD bound to Inverse Agonist SR10221 · A8R A501 · binds ILE262, PHE264, ILE281, GLY284, CYS285, PHE287, ARG288, SER289 and 12 more
- 8B8X · Crystal structure of PPARG and NCOR2 with SR10221, an inverse agonist · A8R A1001 · binds LYS265, HIS266, ILE281, PHE282, GLY284, CYS285, GLN286, ARG288 and 19 more
Residues it binds most
LEU 6, ILE 6, VAL 5, PHE 6, HIS 5, MET 6, SER 6, GLY 6, LYS 5, ARG 6 (residue and the binding sites it lines).
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