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Ligand · VX0

VX0 · (6~{S},7~{R})-6,7-dimethyl-3-(2-oxidanylidenepyrrolidin-1-yl)-~{N}-[3,4,5-tris(fluoranyl)phenyl]-6,7-dihydro-4~{H}-pyrazolo[1,5-a]pyrazine-5-carboxamide

VX0, (6~{S},7~{R})-6,7-dimethyl-3-(2-oxidanylidenepyrrolidin-1-yl)-~{N}-[3,4,5-tris(fluoranyl)phenyl]-6,7-dihydro-4~{H}-pyrazolo[1,5-a]pyrazine-5-carboxamide (C19 H20 F3 N5 O2, 407.4 g/mol), in the MolNFT structures on GenesisL1: bound in…

Component
VX0
Formula
C19 H20 F3 N5 O2
Class
ligand
Structures
1
PDB entries
1

Binding sites

VX0 in 1 structure; the first of them:

  • 8KHU · Hepatitis B virus core protein Y132A mutant in complex with THPP derivatives 48 · VX0 A203 · binds PHE23, PRO25, ASP29, LEU30, THR33, TRP102, ILE105, SER106 and 4 more

Residues it binds most

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

Found with

  • GOL · Glycerol
  • IPA · Isopropyl alcohol

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