GL1X · GenesisL1 explorer

Ligand · 9JM

9JM · [[(2~{R},3~{S},4~{R},5~{R})-5-(3-aminocarbonylpyridin-1-ium-1-yl)-4-[[5-[4-cyano-2-[(~{E})-hydroxyiminomethyl]phenoxy]-1-oxidanyl-3~{H}-2, 1$L^{4}-benzoxaborol-1-yl]oxy]-3-oxidanyl-oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(2~{R},3~{S},4~{R}, 5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl hydrogen phosphate

9JM, [[(2~{R},3~{S},4~{R},5~{R})-5-(3-aminocarbonylpyridin-1-ium-1-yl)-4-[[5-[4-cyano-2-[(~{E})-hydroxyiminomethyl]phenoxy]-1-oxidanyl-3~{H}-2, 1$L^{4}-benzoxaborol-1-yl]oxy]-3-oxidanyl-oxolan-2-yl]methoxy-oxidanyl-phosphoryl]…

Component
9JM
Formula
C36 H38 B N9 O18 P2 +1
Class
ligand
Structures
1
PDB entries
1

Binding sites

9JM in 1 structure; the first of them:

  • 5VRN · Crystal structure of the inha from mycobacterium tuberculosis in complex with AN12855… · 9JM A300 · binds GLY14, ILE15, ILE16, SER20, ILE21, PHE41, LEU63, ASP64 and 18 more

Residues it binds most

ILE 6, GLY 6, ASP 6, PHE 6, SER 6, MET 6, LEU 6, ALA 6, LYS 6, PRO 6 (residue and the binding sites it lines).

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