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Related entries of code: 1i7g
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3kdtRCSB PDB    PDBbind277aa, >3KDT_1|Chains... at 98%
3kduRCSB PDB    PDBbind277aa, >3KDU_1|Chains... at 98%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1i7iRCSB PDB    PDBbindAZ2
Entry Information
PDB ID1i7g
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Nameperoxisome proliferator activated receptor alph
Ligand NameAZ2
EC.Number E.C.-.-.-.-
Resolution 2.2(Å)
Affinity (Kd/Ki/IC50)IC50=1.0uM
Release Year2002
Protein/NA SequenceCheck fasta file
Primary Reference Structure v9 pp. 699-706, 2001
Ligand Properties
Formula C20H24O7S
Molecular Weight 408.465
Exact Mass 408.124
No. of atoms 52
No. of bonds 53
Polar Surface Area 107.51
LOGP Value 4.38      (Computed with XLOGP3)
3.76      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 10
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 2
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): Q07869  
Entrez Gene IDNCBI Entrez Gene ID: 5465  
ASDInformation of known allosteric effects of PDB entries
 
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