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Ligand · JTC

JTC · [(~{E})-2-[2-[(4-oxidanylidene-3,5-dihydropyrrolo[3,2-d]pyrimidin-7-yl)sulfanyl]-5-[2,3,4,5,6-pentakis(fluoranyl)phenoxy]phenyl]ethenyl]phosphonic acid

JTC, [(~{E})-2-[2-[(4-oxidanylidene-3,5-dihydropyrrolo[3,2-d]pyrimidin-7-yl)sulfanyl]-5-[2,3,4,5,6-pentakis(fluoranyl)phenoxy]phenyl]ethenyl]phosphonic acid (C20 H11 F5 N3 O5 P S, 531.4 g/mol), in the MolNFT structures on GenesisL1: bound…

Component
JTC
Formula
C20 H11 F5 N3 O5 P S
Class
ligand
Structures
1
PDB entries
1

Binding sites

JTC in 1 structure; the first of them:

  • 7ZSO · human purine nucleoside phosphorylase in complex with JS-554 · JTC A301 · binds GLY32, SER33, GLY34, ARG84, HIS86, THR114, ASN115, ALA116 and 17 more

Residues it binds most

GLY 3, VAL 3, ALA 3, ASN 3, HIS 3, PHE 3, SER 3, THR 3, ARG 3, GLU 3 (residue and the binding sites it lines).

Found with

  • NA · Sodium ion
  • SO4 · Sulfate ion
  • GOL · Glycerol

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