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Ligand · 5J6

5J6 · methyl 4-(2-bromo-4-fluorophenyl)-6-(morpholin-4-ylmethyl)-2-(1,3-thiazol-2-yl)pyrimidine-5-carboxylate

5J6, methyl 4-(2-bromo-4-fluorophenyl)-6-(morpholin-4-ylmethyl)-2-(1,3-thiazol-2-yl)pyrimidine-5-carboxylate (C20 H18 Br F N4 O3 S, 493.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site…

Component
5J6
Formula
C20 H18 Br F N4 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

5J6 in 2 structures; the first of them:

  • 5E0I · Crystal structure of the HBV capsid Y132A mutant (VCID 8772) in complex with NVR10-001E2… · 5J6 A500 · binds PHE23, PRO25, ASP29, LEU30, THR33, LEU37, TRP102, ILE105 and 6 more
  • 5E0I · Crystal structure of the HBV capsid Y132A mutant (vcid 8772) in complex with NVR10-001E2… · 5J6 A500 · binds PHE23, PRO25, ASP29, LEU30, THR33, LEU37, TRP102, ILE105 and 6 more

Residues it binds most

LEU 12, THR 12, ILE 12, PHE 12, PRO 12, TRP 12, ARG 6, ASP 12, SER 12, TYR 12 (residue and the binding sites it lines).

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