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Ligand · IN0

IN0 · N-{2-[trans-7-chloro-1-(2,2-dimethyl-propyl) -5-naphthalen-1-yl-2-oxo-1,2,3,5-tetrahydro-benzo[e] [1,4]oxazepin-3-yl]-acetyl}-aspartic acid

IN0, N-{2-[trans-7-chloro-1-(2,2-dimethyl-propyl) -5-naphthalen-1-yl-2-oxo-1,2,3,5-tetrahydro-benzo[e] [1,4]oxazepin-3-yl]-acetyl}-aspartic acid (C30 H31 Cl N2 O7, 567.0 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1…

Component
IN0
Formula
C30 H31 Cl N2 O7
Class
ligand
Structures
2
PDB entries
1

Binding sites

IN0 in 2 structures; the first of them:

  • 1EZF · Crystal structure of human squalene synthase · IN0 A991 · binds SER51, ARG52, SER53, PHE54, VAL69, PHE72, TYR73, LEU76 and 15 more
  • 1EZF · Crystal structure of human squalene synthase · IN0 A991 · binds SER51, ARG52, SER53, PHE54, VAL69, PHE72, TYR73, LEU76 and 15 more

Residues it binds most

LEU 6, PHE 6, VAL 6, ALA 6, GLY 6, MET 6, SER 6, ARG 6, CYS 6, GLN 6 (residue and the binding sites it lines).

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