Ligand · WRE
WRE · 2-[(4P)-4-{2-[(2S)-2-methylazetidin-1-yl]-6-(trifluoromethyl)pyrimidin-4-yl}-1H-pyrazol-1-yl]-1-(piperazin-1-yl)ethan-1-one
WRE, 2-[(4P)-4-{2-[(2S)-2-methylazetidin-1-yl]-6-(trifluoromethyl)pyrimidin-4-yl}-1H-pyrazol-1-yl]-1-(piperazin-1-yl)ethan-1-one (C18 H22 F3 N7 O, 409.4 g/mol), in the MolNFT structures on GenesisL1: bound in 1 record (1 PDB entry). Every…
- Component
- WRE
- Formula
- C18 H22 F3 N7 O
- Class
- ligand
- Structures
- 1
- PDB entries
- 1
Binding sites
WRE in 1 structure; the first of them:
- 8UG3 · Crystal structure of KHK-C and compound 23 · WRE A301 · binds ARG108, ASP194, ALA224, TRP225, ALA226, GLU227, GLY229, ALA230 and 14 more
Residues it binds most
ALA 2, GLY 2, CYS 2, PHE 2, PRO 2, ASP 1, GLU 2, THR 2, VAL 2, ARG 1 (residue and the binding sites it lines).
Found with
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