GL1X · GenesisL1 explorer

Ligand · 1VX

1VX · (1S,2R)-2-{[(1S)-5-methyl-1-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-3,4-dihydroisoquinolin-2(1H)-yl]carbonyl}cyclohexanecarboxylic acid

1VX, (1S,2R)-2-{[(1S)-5-methyl-1-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-3,4-dihydroisoquinolin-2(1H)-yl]carbonyl}cyclohexanecarboxylic acid (C27 H30 N2 O4, 446.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1…

Component
1VX
Formula
C27 H30 N2 O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

1VX in 2 structures; the first of them:

  • 4L7D · Structure of keap1 kelch domain with (1S,2R)-2-{[(1S)-5-methyl-1-[(1-oxo-1,3-dihydro-2H-is… · 1VX A701 · binds TYR334, SER363, GLY364, ARG380, ASN382, ASN414, ARG415, GLY462 and 6 more
  • 4L7D · Structure of KEAP1 kelch domain with (1S,2R)-2-{[(1S)-5-methyl-1-[(1… · 1VX A701 · binds TYR334, SER363, GLY364, ARG380, ASN382, ASN414, ARG415, GLY462 and 6 more

Residues it binds most

GLY 6, ARG 6, ASN 6, SER 6, TYR 6, ALA 6, PHE 6 (residue and the binding sites it lines).

Found with

  • ACT · Acetate ion

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