GL1X · GenesisL1 explorer

Ligand · J1L

J1L · 5'-{[(2R,4R)-1-{2-[(2-amino-7,7-dimethyl-4-oxo-3,4,7,8-tetrahydropteridine-6-carbonyl)amino]ethyl}-2-carboxypiperidin-4-yl]sulfonyl}-5'-deoxyadenosine

J1L, 5'-{[(2R,4R)-1-{2-[(2-amino-7,7-dimethyl-4-oxo-3,4,7,8-tetrahydropteridine-6-carbonyl)amino]ethyl}-2-carboxypiperidin-4-yl]sulfonyl}-5'-deoxyadenosine (C27 H36 N12 O9 S, 704.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2…

Component
J1L
Formula
C27 H36 N12 O9 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

J1L in 2 structures; the first of them:

  • 7KDR · Crystal structure of Escherichia coli HPPK in complex with bisubstrate inhibitor HP-75 · J1L A201 · binds GLY8, THR42, PRO43, PRO44, LEU45, TYR53, ASN55, LEU70 and 16 more
  • 7KDR · Crystal structure of escherichia COLI hppk in complex with bisubstrate inhibitor hp-75 · J1L A201 · binds THR42, PRO43, PRO44, LEU45, TYR53, ASN55, LEU70, GLN74 and 15 more

Residues it binds most

LEU 2, ARG 2, ASP 2, PRO 2, THR 2, TYR 2, GLY 2, ASN 2, GLN 2, HIS 2 (residue and the binding sites it lines).

Found with

  • CL · Chloride ion
  • EDO · 1,2-ethanediol

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