Ligand · 1AS
1AS · (~{E})-4-[9-[(4-fluorophenyl)methoxy]-8-methoxy-2,2-dimethyl-7-(3-methylbut-2-enyl)-6-oxidanylidene-pyrano[3,2-b]xanthen-5-yl]oxybut-2-enoic acid
1AS, (~{E})-4-[9-[(4-fluorophenyl)methoxy]-8-methoxy-2,2-dimethyl-7-(3-methylbut-2-enyl)-6-oxidanylidene-pyrano[3,2-b]xanthen-5-yl]oxybut-2-enoic acid (C35 H33 F O8, 600.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records…
- Component
- 1AS
- Formula
- C35 H33 F O8
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
1AS in 2 structures; the first of them:
- 7F2L · Crystal structure of PDE4D catalytic domain complexed with compound 18a · 1AS A603 · binds TYR159, HIS160, HIS164, ASP201, MET273, ASP318, LEU319, ASN321 and 12 more
- 7F2L · Crystal structure of PDE4D catalytic domain complexed with compound 18A · 1AS A603 · binds TYR159, HIS160, HIS164, ASP201, MET273, ASP318, LEU319, ASN321 and 12 more
Residues it binds most
TYR 4, ASP 4, HIS 4, MET 4, PRO 4, PHE 4, ASN 4, GLN 4, GLY 4, ILE 4 (residue and the binding sites it lines).
Found with
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