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Ligand · 684

684 · 4-({5-[(2,4-diaminopteridin-6-yl)methyl]-5H-dibenzo[b,f]azepin-2-yl}oxy)butanoic acid

684, 4-({5-[(2,4-diaminopteridin-6-yl)methyl]-5H-dibenzo[b,f]azepin-2-yl}oxy)butanoic acid (C25 H23 N7 O3, 469.5 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within…

Component
684
Formula
C25 H23 N7 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

684 in 2 structures; the first of them:

  • 3S7A · Human dihydrofolate reductase binary complex with PT684 · 684 A192 · binds ILE7, VAL8, ALA9, GLY20, ASP21, LEU22, GLU30, PHE31 and 11 more
  • 3S7A · Human dihydrofolate reductase binary complex with PT684 · 684 A192 · binds ILE7, VAL8, ALA9, GLY20, ASP21, LEU22, GLU30, PHE31 and 11 more

Residues it binds most

ILE 2, LEU 2, PHE 2, TYR 2, VAL 2, ALA 2, ASN 2, ASP 2, GLN 2, GLU 2 (residue and the binding sites it lines).

Found with

  • SO4 · Sulfate ion

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