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Ligand · E4M

E4M · 1-{4-[(6s,6ar,7r)-3-amino-6,7-dimethyl-1-oxo-1,2,5,6, 6A,7-hexahydro-8H-imidazo[1,5-f]pteridin-10-ium-8-yl]phenyl}-1-deoxy-5-O-{5-O-[(S)-{[(1S)-1,3-dicarboxypropyl]oxy}(hydroxy)phosphoryl]-alpha-D-ribofuranosyl}-D-ribitol

E4M, 1-{4-[(6s,6ar,7r)-3-amino-6,7-dimethyl-1-oxo-1,2,5,6, 6A,7-hexahydro-8H-imidazo[1,5-f]pteridin-10-ium-8-yl]phenyl}-1-deoxy-5-O-{5-O-[(S)-{[(1S)-1,3-dicarboxypropyl]oxy}(hydroxy)phosphoryl]-alpha-D-ribofuranosyl}-D-ribitol (C31 H44 N6…

Component
E4M
Formula
C31 H44 N6 O16 P +1
Class
ligand
Structures
5
PDB entries
3

Binding sites

E4M in 5 structures; the first of them:

  • 6HAV · Crystal structure of [Fe]-hydrogenase (Hmd) from Methanococcus aeolicus in complex with… · E4M A412 · binds SER13, HIS14, CYS17, LYS113, PRO114, PRO150, LYS151, CYS176 and 5 more
  • 6HUX · HmdII from Methanocaldococcus jannaschii reconstitued with Fe-guanylylpyridinol (FeGP)… · E4M A412 · binds LEU24, TYR25, LEU29, PHE102, CYS127, ALA157, VAL159, ALA212 and 3 more
  • 6HAE · Crystal structure of [fe]-hydrogenase (hmd) from methanococcus aeolicus in complex with… · E4M A402 · binds SER13, HIS14, CYS17, LYS113, PRO114, PRO150, LYS151, CYS176 and 10 more
  • 6HAV · Crystal structure of [fe]-hydrogenase (hmd) from methanococcus aeolicus in complex with… · E4M A412 · binds SER13, HIS14, CYS17, LYS113, PRO114, PRO150, LYS151, CYS176 and 5 more
  • 6HUX · Hmdii from methanocaldococcus jannaschii reconstitued with fe- guanylylpyridinol (fegp)… · E4M A412 · binds LEU24, TYR25, LEU29, PHE102, CYS127, ALA157, VAL159, ALA212 and 3 more

Residues it binds most

CYS 6, SER 6, PRO 4, LYS 4, MET 6, ASP 6, ALA 2, GLY 4, HIS 4, LEU 2 (residue and the binding sites it lines).

Found with

  • FE9 · iron-guanylyl pyridinol cofactor
  • NA · Sodium ion
  • CL · Chloride ion
  • SCN · Thiocyanate ion
  • GOL · Glycerol
  • MG · Magnesium ion
  • SO4 · Sulfate ion
  • ACT · Acetate ion
  • EDO · 1,2-ethanediol
  • K · Potassium ion
  • 2PE · Nonaethylene glycol

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