Ligand · TF1
TF1 · 4-({(2R,5S)-2,5-dimethyl-4-[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]piperazin-1-yl}carbonyl)benzonitrile
TF1, 4-({(2R,5S)-2,5-dimethyl-4-[(2R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoyl]piperazin-1-yl}carbonyl)benzonitrile (C18 H20 F3 N3 O3, 383.4 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every…
- Component
- TF1
- Formula
- C18 H20 F3 N3 O3
- Class
- ligand
- Structures
- 4
- PDB entries
- 2
Binding sites
TF1 in 4 structures; the first of them:
- 2BU2 · crystal structures of human pyruvate dehydrogenase kinase 2 containing physiological and… · TF1 A1387 · binds LEU23, GLN27, PHE28, PHE31, THR40, SER41, PHE44, LEU45 and 4 more
- 2BU5 · crystal structures of human pyruvate dehydrogenase kinase 2 containing physiological and… · TF1 A1386 · binds SER21, LEU23, GLN27, PHE28, PHE31, THR40, SER41, PHE44 and 5 more
- 2BU2 · Crystal structures of human pyruvate dehydrogenase kinase 2 containing physiological and… · TF1 A1387 · binds LEU23, GLN27, PHE28, PHE31, THR40, SER41, PHE44, LEU45 and 4 more
- 2BU5 · Crystal structures of human pyruvate dehydrogenase kinase 2 containing physiological and… · TF1 A1386 · binds SER21, LEU23, GLN27, PHE28, PHE31, THR40, SER41, PHE44 and 5 more
Residues it binds most
LEU 4, PHE 4, GLN 4, SER 4, HIS 4, ILE 4, THR 4 (residue and the binding sites it lines).
Found with
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