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Ligand · X2G

X2G · 4-{3-[(E)-2-cyanoethenyl]-5-fluorophenoxy}-3-[2-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)ethoxy]phenyl sulfurofluoridate

X2G, 4-{3-[(E)-2-cyanoethenyl]-5-fluorophenoxy}-3-[2-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)ethoxy]phenyl sulfurofluoridate (C21 H15 F2 N3 O7 S, 491.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every…

Component
X2G
Formula
C21 H15 F2 N3 O7 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

X2G in 2 structures; the first of them:

  • 7KRF · Crystal Structure of HIV-1 Reverse Transcriptase in Complex with… · X2G A601 · binds PRO95, LEU100, LYS101, LYS102, LYS103, VAL106, VAL108, VAL179 and 12 more
  • 7KRF · Crystal structure of HIV-1 reverse transcriptase in complex with (E)… · X2G A601 · binds PRO95, LEU100, LYS101, LYS102, LYS103, VAL106, VAL108, VAL179 and 12 more

Residues it binds most

VAL 2, LYS 2, PRO 2, TYR 2, LEU 2, GLU 2, GLY 2, HIS 2, PHE 2, TRP 2 (residue and the binding sites it lines).

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