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Ligand · 0HJ

0HJ · 6-O-[(2S)-2-{(1S)-18-[(1R,2R)-2-hexylcyclopropyl]-1-hydroxyoctadecyl}tricosanoyl]-alpha-D-glucopyranosyl alpha-D-glucopyranoside

0HJ, 6-O-[(2S)-2-{(1S)-18-[(1R,2R)-2-hexylcyclopropyl]-1-hydroxyoctadecyl}tricosanoyl]-alpha-D-glucopyranosyl alpha-D-glucopyranoside (C62 H118 O13, 1071.6 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry).…

Component
0HJ
Formula
C62 H118 O13
Class
ligand
Structures
2
PDB entries
1

Binding sites

0HJ in 2 structures; the first of them:

  • 7N6B · Structure of MmpL3 reconstituted into lipid nanodisc in the TMM bound state · 0HJ A1101 · binds LEU409, ILE416, LEU419, GLY420, LEU422, SER423, LEU424, ILE557 and 17 more
  • 7N6B · Structure of MMPL3 reconstituted into lipid nanodisc in the tmm bound state · 0HJ A1101 · binds LEU409, ILE416, LEU419, LEU422, LEU424, PHE561, LEU564, ALA568 and 9 more

Residues it binds most

LEU 4, ILE 4, ALA 4, THR 4, GLY 4, PHE 4, VAL 3, GLN 2, SER 3, ASP 2 (residue and the binding sites it lines).

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