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Ligand · TT2

TT2 · (1R,3R,7E,17beta)-17-{(1S,2E,5R)-5-hydroxy-1-methyl-5-[(3S,5S,7S)-tricyclo[3.3.1.1~3,7~]dec-1-yl]pent-2-en-1-yl}-2-methylidene-9,10-secoestra-5,7-diene-1,3-diol

TT2, (1R,3R,7E,17beta)-17-{(1S,2E,5R)-5-hydroxy-1-methyl-5-[(3S,5S,7S)-tricyclo[3.3.1.1~3,7~]dec-1-yl]pent-2-en-1-yl}-2-methylidene-9,10-secoestra-5,7-diene-1,3-diol (C35 H52 O3, 520.8 g/mol), in the MolNFT structures on GenesisL1: bound…

Component
TT2
Formula
C35 H52 O3
Class
ligand
Structures
2
PDB entries
1

Binding sites

TT2 in 2 structures; the first of them:

  • 2ZMI · Crystal Structure of Rat Vitamin D Receptor Bound to Adamantyl Vitamin D Analogs… · TT2 A1 · binds TYR143, TYR147, PHE150, LEU223, LEU226, ALA227, LEU229, VAL230 and 20 more
  • 2ZMI · Crystal structure of rat vitamin D receptor bound to adamantyl vitamin D analogs… · TT2 A1 · binds TYR143, TYR147, PHE150, LEU223, LEU226, ALA227, LEU229, VAL230 and 20 more

Residues it binds most

LEU 2, TYR 2, SER 2, VAL 2, ALA 2, HIS 2, ILE 2, ARG 2, CYS 2, MET 2 (residue and the binding sites it lines).

Found with

  • EDO · 1,2-ethanediol
  • FMT · Formic acid

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