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Ligand · B9R

B9R · N-[(2S)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-N~2~-methyl-L-valinamide

B9R, N-[(2S)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-N~2~-methyl-L-valinamide (C17 H25 N3 O2, 303.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the…

Component
B9R
Formula
C17 H25 N3 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

B9R in 2 structures; the first of them:

  • 6J83 · Crystal structure of TleB with NMVT · B9R A402 · binds ILE80, THR82, LEU85, PHE169, SER170, VAL231, ILE234, ALA235 and 7 more
  • 6J83 · Crystal structure of tleb with nmvt · B9R A402 · binds ILE80, THR82, LEU85, PHE169, SER170, VAL231, ILE234, ALA235 and 7 more

Residues it binds most

ILE 2, THR 2, VAL 2, PHE 2, ALA 2, GLN 2, LEU 2, SER 2 (residue and the binding sites it lines).

Found with

  • HEM · Protoporphyrin IX containing Fe

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