Ligand · B4I
B4I · 4-({(2S,3S)-3-[(1S)-1-(3,5-dichlorophenyl)-2-hydroxyethoxy]-2-phenylpiperidin-1-yl}methyl)-3-nitrobenzoic acid
B4I, 4-({(2S,3S)-3-[(1S)-1-(3,5-dichlorophenyl)-2-hydroxyethoxy]-2-phenylpiperidin-1-yl}methyl)-3-nitrobenzoic acid (C27 H26 Cl2 N2 O6, 545.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding…
- Component
- B4I
- Formula
- C27 H26 Cl2 N2 O6
- Class
- ligand
- Structures
- 2
- PDB entries
- 1
Binding sites
B4I in 2 structures; the first of them:
- 7SSB · Co-structure of PKG1 regulatory domain with compound 33 · B4I A9901 · binds THR236, PHE237, LEU240, LEU248, PHE273, TRP304, GLU307, LEU310 and 4 more
- 7SSB · Co-structure of PKG1 regulatory domain with compound 33 · B4I A9901 · binds THR236, PHE237, LEU240, LEU248, PHE273, TRP304, GLU307, LEU310 and 3 more
Residues it binds most
LEU 2, PHE 2, ILE 2, GLN 2, GLU 2, THR 2, TRP 2 (residue and the binding sites it lines).
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