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Ligand · 2KB

2KB · 4-{[(1R,2S,3R,5Z,7E,14beta,17alpha)-1,3,25-trihydroxy-9,10-secocholesta-5,7,10-trien-2-yl]oxy}butanenitrile

2KB, 4-{[(1R,2S,3R,5Z,7E,14beta,17alpha)-1,3,25-trihydroxy-9,10-secocholesta-5,7,10-trien-2-yl]oxy}butanenitrile (C31 H49 N O4, 499.7 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with…

Component
2KB
Formula
C31 H49 N O4
Class
ligand
Structures
2
PDB entries
1

Binding sites

2KB in 2 structures; the first of them:

  • 5GT4 · Crystal structure of the human vitamin D receptor ligand binding domain complexed with… · 2KB A501 · binds TYR143, ASP144, PRO145, TYR147, PHE150, LEU227, LEU230, LEU233 and 21 more
  • 5GT4 · Crystal structure of the human vitamin D receptor ligand binding domain complexed with… · 2KB A501 · binds TYR143, ASP144, PRO145, TYR147, PHE150, LEU227, LEU230, LEU233 and 21 more

Residues it binds most

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

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