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Ligand · R45

R45 · N-{(2S)-3-[(S)-(4-bromophenyl)(hydroxy)phosphoryl]-2-[(3-phenyl-1,2-oxazol-5-yl)methyl]propanoyl}-L-alpha-glutamyl-L-al pha-glutamine

R45, N-{(2S)-3-[(S)-(4-bromophenyl)(hydroxy)phosphoryl]-2-[(3-phenyl-1,2-oxazol-5-yl)methyl]propanoyl}-L-alpha-glutamyl-L-al pha-glutamine (C29 H32 Br N4 O10 P, 707.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB…

Component
R45
Formula
C29 H32 Br N4 O10 P
Class
ligand
Structures
2
PDB entries
1

Binding sites

R45 in 2 structures; the first of them:

  • 4GR3 · Crystal structure of the catalytic domain of Human MMP12 in complex with selective… · R45 A306 · binds HIS172, GLY178, GLY179, ILE180, LEU181, ALA182, HIS183, LEU214 and 12 more
  • 4GR3 · Crystal structure of the catalytic domain of human MMP12 in complex with selective… · R45 A306 · binds HIS172, GLY178, GLY179, ILE180, LEU181, ALA182, HIS183, LEU214 and 12 more

Residues it binds most

HIS 2, ALA 2, GLY 2, LEU 2, THR 2, GLU 2, ILE 2, LYS 2, PHE 2, PRO 2 (residue and the binding sites it lines).

Found with

  • CA · Calcium ion
  • ZN · Zinc ion

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