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Ligand · B20

B20 · 1,2-dihydro-1,2-azaborinine

B20, 1,2-dihydro-1,2-azaborinine (C4 H6 B N, 78.9 g/mol), in the MolNFT structures on GenesisL1: bound in 5 records (3 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with…

Component
B20
Formula
C4 H6 B N
Class
ligand
Structures
5
PDB entries
3

Binding sites

B20 in 5 structures; the first of them:

  • 3HH3 · New azaborine compounds bind to the T4 lysozyme L99A cavity - 1,2-dihydro-1,2-azaborine · B20 A169 · binds LEU84, VAL87, TYR88, LEU91, ALA99, MET102, VAL103, VAL111 and 3 more
  • 5JWU · T4 Lysozyme L99A/M102Q with 1,2-Dihydro-1,2-azaborine Bound · B20 A201 · binds ILE78, LEU84, VAL87, TYR88, LEU91, ALA99, GLN102, VAL103 and 3 more
  • 7SJ6 · T4 Lysozyme L99A/M102H with 1,2-Azaborine bound · B20 A201 · binds ILE78, LEU84, VAL87, TYR88, LEU91, ALA99, HIS102, VAL103 and 4 more
  • 3HH3 · New azaborine compounds bind to the T4 lysozyme L99A cavity - 1,2- dihydro-1,2-azaborine · B20 A169 · binds LEU84, VAL87, TYR88, LEU91, ALA99, MET102, VAL103, VAL111 and 3 more
  • 5JWU · T4 lysozyme L99A/M102Q with 1,2-dihydro-1,2-azaborine bound · B20 A201 · binds ILE78, LEU84, VAL87, TYR88, LEU91, ALA99, GLN102, VAL103 and 3 more

Residues it binds most

LEU 6, VAL 6, ALA 6, PHE 6, TYR 6, ILE 4, GLN 2, HIS 2, MET 2 (residue and the binding sites it lines).

Found with

  • HED · 2-hydroxyethyl disulfide
  • NA · Sodium ion
  • CL · Chloride ion
  • PO4 · Phosphate ion
  • SO4 · Sulfate ion
  • ACT · Acetate ion
  • BME · Beta-mercaptoethanol

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