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Ligand · TMH

TMH · (+)-alpha-Pinene

TMH, (+)-alpha-Pinene (C10 H16, 136.2 g/mol), in the MolNFT structures on GenesisL1: bound in 6 records (3 PDB entries). Every binding site with its residues within 4.5 Å, the residues it binds most and the ligands found with it.

Component
TMH
Formula
C10 H16
Class
ligand
Structures
6
PDB entries
3

Binding sites

TMH in 6 structures; the first of them:

  • 1MPW · Molecular Recognition in (+)-a-Pinene Oxidation by Cytochrome P450cam · TMH A1450 · binds TRP87, THR101, LEU244, LEU247, GLY248, THR252, VAL295, ASP297 and 2 more
  • 4I91 · Crystal Structure of Cytochrome P450 2B6 (Y226H/K262R) in complex with alpha-Pinene. · TMH A506 · binds ILE101, ILE114, PHE115, PHE206, PHE297, ALA298, THR302, LEU363 and 1 more
  • 4ZV8 · Structure of CYP2B6 (Y226H/K262R) with additional mutation Y244W in complex with… · TMH A502 · binds ILE101, ILE114, PHE115, PHE206, PHE297, ALA298, THR302, LEU363 and 2 more
  • 1MPW · Molecular recognition in (+)-a-pinene oxidation by cytochrome P450CAM · TMH A1450 · binds TRP87, THR101, LEU244, LEU247, GLY248, THR252, VAL295, ASP297 and 2 more
  • 4I91 · Crystal structure of cytochrome P450 2B6 (Y226H/K262R) in complex with alpha-pinene. · TMH A506 · binds ILE101, ILE114, PHE115, PHE206, PHE297, ALA298, THR302, LEU363 and 1 more
  • 4ZV8 · Structure of CYP2B6 (Y226H/K262R) with additional mutation Y244W in complex with… · TMH A502 · binds ILE101, ILE114, PHE115, PHE206, PHE297, ALA298, THR302, LEU363 and 2 more

Residues it binds most

THR 8, VAL 8, LEU 8, PHE 4, ILE 6, ALA 4, ASP 4, GLY 4, TRP 4 (residue and the binding sites it lines).

Found with

  • HEM · Protoporphyrin IX containing Fe
  • CM5 · 5-cyclohexyl-1-pentyl-beta-D-maltoside
  • K · Potassium ion
  • FRU · beta-D-fructofuranose

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