GL1X · GenesisL1 explorer

Ligand · L0K

L0K · ~{N}-[2-methoxy-5-(1,2,4,5-tetrahydro-3-benzazepin-3-ylsulfonyl)phenyl]-2-(4-oxidanylidene-3~{H}-phthalazin-1-yl)ethanamide

L0K, ~{N}-[2-methoxy-5-(1,2,4,5-tetrahydro-3-benzazepin-3-ylsulfonyl)phenyl]-2-(4-oxidanylidene-3~{H}-phthalazin-1-yl)ethanamide (C27 H26 N4 O5 S, 518.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
L0K
Formula
C27 H26 N4 O5 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

L0K in 2 structures; the first of them:

  • 6S88 · Fumarate hydratase of Mycobacterium tuberculosis in complex with formate and allosteric… · L0K A501 · binds LEU303, THR304, GLY305, LEU429, LYS430, ARG432, PRO302, LEU303 and 8 more
  • 6S88 · Fumarate hydratase of mycobacterium tuberculosis in complex with formate and allosteric… · L0K A501 · binds LEU303, THR304, GLY305, LEU429, LYS430, ARG432, LEU303, GLY305 and 6 more

Residues it binds most

LEU 4, ARG 4, GLY 4, ALA 4, ASN 4, HIS 4, LYS 4, THR 4, PRO 2 (residue and the binding sites it lines).

Found with

  • MG · Magnesium ion
  • FMT · Formic acid

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