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Ligand · 6NN

6NN · P-((((benzyloxy)carbonyl)amino)methyl)-N-((S)-4-methyl-1-(((R)-2-methylbutyl)amino)-1-oxopentan- 2-yl)phosphonamidic acid

6NN, P-((((benzyloxy)carbonyl)amino)methyl)-N-((S)-4-methyl-1-(((R)-2-methylbutyl)amino)-1-oxopentan- 2-yl)phosphonamidic acid (C20 H34 N3 O5 P, 427.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
6NN
Formula
C20 H34 N3 O5 P
Class
ligand
Structures
2
PDB entries
1

Binding sites

6NN in 2 structures; the first of them:

  • 5JXN · Thermolysin in complex with JC240. · 6NN E411 · binds ASN111, ASN112, ALA113, PHE114, TRP115, ASN116, PHE130, LEU133 and 10 more
  • 5JXN · Thermolysin in complex with JC240. · 6NN E411 · binds ASN111, ASN112, ALA113, PHE114, TRP115, ASN116, PHE130, LEU133 and 10 more

Residues it binds most

ASN 2, HIS 2, GLU 2, LEU 2, PHE 2, ALA 2, ARG 2, ILE 2, TRP 2, TYR 2 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • ZN · Zinc ion
  • DMS · Dimethyl sulfoxide
  • GOL · Glycerol

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