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Ligand · 29J

29J · 4-[(1R)-2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenol

29J, 4-[(1R)-2-(dimethylamino)-1-(1-hydroxycyclohexyl)ethyl]phenol (C16 H25 N O2, 263.4 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site with its residues within 4.5 Å, the residues it…

Component
29J
Formula
C16 H25 N O2
Class
ligand
Structures
4
PDB entries
2

Binding sites

29J in 4 structures; the first of them:

  • 4MM7 · Crystal structure of LeuBAT (delta13 mutant) in complex with desvenlafaxine · 29J A603 · binds TYR21, ALA22, ASP24, PRO101, VAL104, ALA105, TYR107, TYR108 and 9 more
  • 4MMC · Crystal structure of LeuBAT (delta6 mutant) in complex with desvenlafaxine · 29J A603 · binds TYR21, ALA22, ASP24, PRO101, VAL104, ALA105, TYR107, TYR108 and 9 more
  • 4MM7 · Crystal structure of leubat (DELTA13 mutant) in complex with desvenlafaxine · 29J A603 · binds TYR21, ALA22, ASP24, PRO101, VAL104, ALA105, TYR107, TYR108 and 9 more
  • 4MMC · Crystal structure of leubat (DELTA6 mutant) in complex with desvenlafaxine · 29J A603 · binds TYR21, ALA22, ASP24, PRO101, VAL104, ALA105, TYR107, TYR108 and 9 more

Residues it binds most

ASP 6, TYR 4, GLY 6, PHE 6, SER 4, ALA 4, LEU 4, VAL 4, PRO 4, THR 4 (residue and the binding sites it lines).

Found with

  • NA · Sodium ion
  • BOG · octyl beta-D-glucopyranoside

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