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Ligand · W05

W05 · Delta-(L-alpha-aminoadipoyl)-L-cysteinyl-D-alanine

W05, Delta-(L-alpha-aminoadipoyl)-L-cysteinyl-D-alanine (C12 H21 N3 O6 S, 335.4 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
W05
Formula
C12 H21 N3 O6 S
Class
ligand
Structures
4
PDB entries
2

Binding sites

W05 in 4 structures; the first of them:

  • 1W05 · Isopenicillin N Synthase Aminoadipoyl-Cysteinyl-Alanine-Fe Complex · W05 A1332 · binds ARG87, TYR91, CYS104, SER183, VAL185, ILE187, TYR189, PHE211 and 11 more
  • 1W06 · Isopenicillin N Synthase Aminoadipoyl-Cysteinyl-Alanine-Fe NO Complex · W05 A1332 · binds ARG87, TYR91, CYS104, SER183, VAL185, ILE187, TYR189, PHE211 and 11 more
  • 1W05 · Isopenicillin N synthase aminoadipoyl-cysteinyl-alanine-fe complex · W05 A1332 · binds ARG87, TYR91, CYS104, SER183, VAL185, ILE187, TYR189, PHE211 and 11 more
  • 1W06 · Isopenicillin N synthase aminoadipoyl-cysteinyl-alanine-fe no complex · W05 A1332 · binds ARG87, TYR91, CYS104, SER183, VAL185, ILE187, TYR189, PHE211 and 11 more

Residues it binds most

LEU 4, PHE 4, SER 4, TYR 4, VAL 4, ARG 4, ASP 4, CYS 4, GLN 4, HIS 4 (residue and the binding sites it lines).

Found with

  • FE2 · Fe (II) ion
  • SO4 · Sulfate ion
  • HOA · Hydroxyamine

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