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Related entries of code: 5kw2
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
4phuRCSB PDB    PDBbind491aa, >4PHU_1|Chain... *
5tzyRCSB PDB    PDBbind491aa, >5TZY_1|Chain... at 99%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID5kw2
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameFree fatty acid receptor 1,Lysozyme,Free fatty acid receptor 1
Ligand Name6XQ
EC.Number E.C.3.2.1.17
Resolution 2.76(Å)
Affinity (Kd/Ki/IC50)Ki=0.81nM
Release Year2018
Protein/NA SequenceCheck fasta file
Primary Reference (2018) Nat Commun Vol. 9: pp. 1645-1645
Ligand Properties
Formula C38H45N3O5
Molecular Weight 623.781
Exact Mass 623.336
No. of atoms 91
No. of bonds 96
Polar Surface Area 96.11
LOGP Value 9.21      (Computed with XLOGP3)
8.26      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 11
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 6
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): O14842  P00720  
Entrez Gene IDNCBI Entrez Gene ID: 2864  1258585  
ASDInformation of known allosteric effects of PDB entries

 
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