Browse entries in the PDBbind-CN Database

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Related entries of code: 3hf8
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3hf6RCSB PDB    PDBbind290aa, >3HF6_1|Chain... at 99%
3hfbRCSB PDB    PDBbind290aa, >3HFB_1|Chain... at 99%
5j6dRCSB PDB    PDBbind307aa, >5J6D_1|Chains... at 98%
5l01RCSB PDB    PDBbind444aa, >5L01_1|Chain... *
5tpgRCSB PDB    PDBbind307aa, >5TPG_1|Chain... at 97%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID3hf8
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein Namehuman tryoptophan hydroxylase type 1
Ligand NameML0
EC.Number E.C.1.14.16.4
Resolution 1.85(Å)
Affinity (Kd/Ki/IC50)Ki=0.31uM
Release Year2010
Protein/NA SequenceCheck fasta file
Primary Reference (2010) Curr Chem Genomics Vol. 4: pp. 19-26
Ligand Properties
Formula C27H23F4N4O3
Molecular Weight 527.490
Exact Mass 527.171
No. of atoms 61
No. of bonds 64
Polar Surface Area 125.97
LOGP Value 3.74      (Computed with XLOGP3)
5.03      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 4
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): P17752  
Entrez Gene IDNCBI Entrez Gene ID: 7166  
ASDInformation of known allosteric effects of PDB entries

 
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