Ligand · 8I9
8I9 · ~{S}-[2-[3-[[(2~{R})-4-[[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-oxidanyl-phosphoryl]oxy-3,3-dimethyl-2-oxidanyl-butanoyl]amino]propanoylamino]ethyl] tridecanethioate
8I9, ~{S}-[2-[3-[[(2~{R})-4-[[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-oxidanyl-phosphoryl]oxy-3,3-dimethyl-2-oxidanyl-butanoyl]amino]propanoylamino]ethyl]…
- Component
- 8I9
- Formula
- C34 H60 N7 O17 P3 S
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
8I9 in 2 structures; the first of them:
- 7W6G · TKS-L190G mutant from Cannabis sativa in complex with lauroyl-CoA · 8I9 C401 · binds MET130, ILE52, LYS55, SER56, ALA125, CSD157, MET187, CYS189 and 26 more
- 7W6G · Tks-L190G mutant from cannabis sativa in complex with lauroyl-CoA · 8I9 C401 · binds ILE52, LYS55, SER56, ALA125, CSD157, MET187, GLY190, PHE191 and 19 more
Residues it binds most
GLY 4, ILE 4, LEU 4, LYS 4, PHE 4, ALA 4, MET 4, VAL 4, SER 4, ASP 4 (residue and the binding sites it lines).
Found with
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