Ligand · PDB
PDB · 1-(2-chlorophenyl)-6-[(2R)-3,3,3-trifluoro-2-methylpropyl]-1,7-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
PDB, 1-(2-chlorophenyl)-6-[(2R)-3,3,3-trifluoro-2-methylpropyl]-1,7-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one (C15 H12 Cl F3 N4 O, 356.7 g/mol), in the MolNFT structures on GenesisL1: bound in 4 records (2 PDB entries). Every binding site…
- Component
- PDB
- Formula
- C15 H12 Cl F3 N4 O
- Class
- ligand
- Structures
- 4
- PDB entries
- 2
Binding sites
PDB in 4 structures; the first of them:
- 3K3E · Crystal structure of the PDE9A catalytic domain in complex with (R)-BAY73-6691 · PDB A600 · binds PHE251, HIS252, MET365, ASP402, ILE403, ASN405, GLU406, VAL417 and 7 more
- 3QI3 · Crystal structure of PDE9A(Q453E) in complex with inhibitor BAY73-6691 · PDB A600 · binds PHE251, HIS252, MET365, ASP402, ILE403, ASN405, GLU406, LEU420 and 7 more
- 3K3E · Crystal structure of the PDE9A catalytic domain in complex with (R)- BAY73-6691 · PDB A600 · binds PHE251, HIS252, MET365, ASP402, ILE403, ASN405, GLU406, VAL417 and 7 more
- 3QI3 · Crystal structure of PDE9A(Q453E) in complex with inhibitor BAY73-6691 · PDB A600 · binds PHE251, HIS252, MET365, ASP402, ILE403, ASN405, GLU406, LEU420 and 7 more
Residues it binds most
PHE 8, LEU 8, GLU 8, VAL 8, ALA 8, ILE 8, MET 8, TYR 8, ASN 6, HIS 6 (residue and the binding sites it lines).
Found with
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