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Ligand · 3E5

3E5 · N-[(benzyloxy)carbonyl]-L-leucyl-N-{(2S,3S)-1-[(2,4-dimethylphenyl)amino]-2-hydroxy-5-methyl-1-oxohexan-3-yl}-L-leucinamide

3E5, N-[(benzyloxy)carbonyl]-L-leucyl-N-{(2S,3S)-1-[(2,4-dimethylphenyl)amino]-2-hydroxy-5-methyl-1-oxohexan-3-yl}-L-leucinamide (C35 H52 N4 O6, 624.8 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
3E5
Formula
C35 H52 N4 O6
Class
ligand
Structures
2
PDB entries
1

Binding sites

3E5 in 2 structures; the first of them:

  • 4R02 · yCP in complex with BSc4999 (alpha-Keto Phenylamide) · 3E5 K301 · binds THR1, ARG19, ALA20, THR21, ALA27, VAL31, LYS33, MET45 and 13 more
  • 4R02 · Ycp in complex with BSC4999 (alpha-keto phenylamide) · 3E5 K301 · binds THR1, ARG19, ALA20, THR21, ALA27, VAL31, LYS33, MET45 and 13 more

Residues it binds most

ALA 4, GLY 4, PRO 4, SER 4, THR 4, TYR 4, VAL 4, ARG 4, ASP 4, LYS 4 (residue and the binding sites it lines).

Found with

  • MG · Magnesium ion

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