GL1X · GenesisL1 explorer

Ligand · 6XU

6XU · (2S)-4,4-difluoro-1-[[(4S)-4-(4-fluorophenyl)-5-methoxycarbonyl-4-methyl-2-(1,3-thiazol-2-yl)-1H-pyrimidin-6-yl]methyl]pyrrolidine-2-carboxylic acid

6XU, (2S)-4,4-difluoro-1-[[(4S)-4-(4-fluorophenyl)-5-methoxycarbonyl-4-methyl-2-(1,3-thiazol-2-yl)-1H-pyrimidin-6-yl]methyl]pyrrolidine-2-carboxylic acid (C22 H21 F3 N4 O4 S, 494.5 g/mol), in the MolNFT structures on GenesisL1: bound in 1…

Component
6XU
Formula
C22 H21 F3 N4 O4 S
Class
ligand
Structures
1
PDB entries
1

Binding sites

6XU in 1 structure; the first of them:

  • 5GMZ · Hepatitis B virus core protein Y132A mutant in complex with 4-methyl… · 6XU A205 · binds PHE23, PRO25, ASP29, LEU30, THR33, LEU37, TRP102, ILE105 and 7 more

Residues it binds most

LEU 7, THR 7, SER 7, ILE 6, PHE 6, TRP 7, PRO 6, ASP 7, ARG 3, TYR 6 (residue and the binding sites it lines).

Found with

  • CL · Chloride ion
  • GOL · Glycerol
  • IPA · Isopropyl alcohol

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