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Ligand · FBL

FBL · (2S)-1-[4-({4-[(2,5-dichlorophenyl)amino]pyrimidin-2-yl}amino)phenoxy]-3-(dimethylamino)propan-2-ol

FBL, (2S)-1-[4-({4-[(2,5-dichlorophenyl)amino]pyrimidin-2-yl}amino)phenoxy]-3-(dimethylamino)propan-2-ol (C21 H23 Cl2 N5 O2, 448.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its…

Component
FBL
Formula
C21 H23 Cl2 N5 O2
Class
ligand
Structures
2
PDB entries
1

Binding sites

FBL in 2 structures; the first of them:

  • 1H01 · CDK2 in complex with a disubstituted 2, 4-bis anilino pyrimidine CDK4 inhibitor · FBL A302 · binds ILE10, GLY11, GLU12, GLY13, VAL18, ALA31, KCX33, VAL64 and 14 more
  • 1H01 · CDK2 in complex with a disubstituted 2, 4-bis anilino pyrimidine CDK4 inhibitor · FBL A302 · binds ILE10, GLY11, GLU12, GLY13, VAL18, ALA31, KCX33, VAL64 and 14 more

Residues it binds most

ALA 2, ASP 2, GLN 2, GLU 2, GLY 2, LEU 2, LYS 2, PHE 2, VAL 2, ASN 2 (residue and the binding sites it lines).

Found with

  • FAL · (2R)-1-[4-({4-[(2,5-dichlorophenyl)amino]pyrimidin-2-yl}amino)phenoxy]-3-(dimethylamino)propan-2-ol
  • GOL · Glycerol

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