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Ligand · BOC

BOC · Tert-butyl hydrogen carbonate

BOC, Tert-butyl hydrogen carbonate (C5 H10 O3, 118.1 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (4 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found…

Component
BOC
Formula
C5 H10 O3
Class
ligand
Structures
4
PDB entries
4

Binding sites

BOC in 4 structures; the first of them:

  • 7AGB · Protease SAPP1P from candida parapsilosis in complex with KB70 · BOC I1 · binds THR224, LEU225, TYR227, TYR285, VAL2
  • 7AGC · Protease SAPP1P from candida parapsilosis in complex with KB74 · BOC E1 · binds THR224, LEU225, TYR227, TYR285, VAL2
  • 7AGD · Protease SAPP1P from candida parapsilosis in complex with KB75 · BOC I1 · binds THR224, LEU225, TYR227, TYR285, VAL2
  • 7AGE · Protease SAPP1P from candida parapsilosis in complex with KB32 · BOC I1 · binds THR224, LEU225, TYR227, TYR285, VAL2

Residues it binds most

TYR 16, LEU 16, THR 16, VAL 16 (residue and the binding sites it lines).

Found with

  • MES · 2-(N-morpholino)-ethanesulfonic acid
  • PEG · Di(hydroxyethyl)ether
  • PGE · Triethylene glycol
  • FOR · Formyl group
  • PSA · 3-hydroxy-4-amino-5-phenylpentanoic acid
  • NA · Sodium ion
  • 1PE · Pentaethylene glycol
  • PE3 · 3,6,9,12,15,18,21,24,27,30,33,36,39-tridecaoxahentetracontane-1,41-diol

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