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Ligand · VUR

VUR · (S)-2-amino-5-(2-mercaptoacetimidamido)pentanoic acid

VUR, (S)-2-amino-5-(2-mercaptoacetimidamido)pentanoic acid (C7 H15 N3 O2 S, 205.3 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds…

Component
VUR
Formula
C7 H15 N3 O2 S
Class
ligand
Structures
4
PDB entries
2

Binding sites

VUR in 4 structures; the first of them:

  • 5AGO · Structure of rat neuronal nitric oxide synthase heme domain in complex with… · VUR A800 · binds GLN478, TRP561, TYR562, PRO565, ALA566, VAL567, PHE584, SER585 and 6 more
  • 5AGP · Structure of rat neuronal nitric oxide synthase heme domain in complex with… · VUR A800 · binds GLN478, TYR562, PRO565, VAL567, PHE584, GLY586, TRP587, TYR588 and 3 more
  • 5AGO · Structure of rat neuronal nitric oxide synthase heme domain in complex with… · VUR A800 · binds GLN478, TRP561, TYR562, PRO565, ALA566, VAL567, PHE584, SER585 and 6 more
  • 5AGP · Structure of rat neuronal nitric oxide synthase heme domain in complex with… · VUR A800 · binds GLN478, TYR562, PRO565, VAL567, PHE584, GLY586, TRP587, TYR588 and 3 more

Residues it binds most

TYR 8, TRP 8, ASP 8, GLN 8, GLU 8, GLY 8, ILE 8, PHE 8, PRO 8, VAL 8 (residue and the binding sites it lines).

Found with

  • H4B · 5,6,7,8-tetrahydrobiopterin
  • HEM · Protoporphyrin IX containing Fe
  • ZN · Zinc ion
  • ACT · Acetate ion

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