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Ligand · 33D

33D · 3,3-dimethylbutan-1-ol

33D, 3,3-dimethylbutan-1-ol (C6 H14 O, 102.2 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.

Component
33D
Formula
C6 H14 O
Class
ligand
Structures
2
PDB entries
1

Binding sites

33D in 2 structures; the first of them:

  • 3ZVW · Unexpected tricovalent binding mode of boronic acids within the active site of a… · 33D B620 · binds TRP139, ASP142, ARG351, MET414, SER415
  • 3ZVW · Unexpected tricovalent binding mode of boronic acids within the active site of a… · 33D B620 · binds TRP139, ASP142, ARG351, MET414, SER415

Residues it binds most

ARG 4, ASP 4, MET 4, SER 4, TRP 4 (residue and the binding sites it lines).

Found with

  • ACN · Acetone
  • FP5 · Phenylacetamidomethyl boronic acid
  • MG · Magnesium ion
  • SO4 · Sulfate ion
  • MES · 2-(N-morpholino)-ethanesulfonic acid

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