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Related entries of code: 4jpy
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3tcyRCSB PDB    PDBbind302aa, >3TCY_1|Chain... *
3tk2RCSB PDB    PDBbind302aa, >3TK2_1|Chain... at 98%
4jpxRCSB PDB    PDBbind302aa, >4JPX_1|Chain... at 98%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1f2pRCSB PDB    PDBbindPHE
1usiRCSB PDB    PDBbindPHE
2ypoRCSB PDB    PDBbindPHE
3tcyRCSB PDB    PDBbindPHE
3tk2RCSB PDB    PDBbindPHE
4fxjRCSB PDB    PDBbindPHE
4io7RCSB PDB    PDBbindPHE
4jpxRCSB PDB    PDBbindPHE
4uc5RCSB PDB    PDBbindPHE
6gg4RCSB PDB    PDBbindPHE
Entry Information
PDB ID4jpy
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NamePhenylalanine-4-hydroxylase
Ligand NamePHE
EC.Number E.C.1.14.16.1
Resolution 2.13(Å)
Affinity (Kd/Ki/IC50)Kd=37uM
Release Year2013
Protein/NA SequenceCheck fasta file
Primary Reference (2013) Eur.Biophys.J. Vol. 42: pp. 691-708
Ligand Properties
Formula C9H12NO2
Molecular Weight 166.197
Exact Mass 166.087
No. of atoms 24
No. of bonds 24
Polar Surface Area 64.94
LOGP Value -0.53      (Computed with XLOGP3)
-0.08      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 3
No. of Rings: 1
Canonical SMILES
InChI String

Links to External Databases
RCSB PDBThe mother database
PDBsumEnhanced annotations on PDB entries
PubchemComprehensive collection of chemical and biological data
UniProtKB ACUniProt accession number (AC): P30967  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries
 
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