Browse entries in the PDBbind-CN Database

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Related entries of code: 5fnq
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
4l7bRCSB PDB    PDBbind300aa, >4L7B_1|Chains... at 96%
4l7cRCSB PDB    PDBbind300aa, >4L7C_1|Chains... at 96%
4l7dRCSB PDB    PDBbind300aa, >4L7D_1|Chains... at 96%
4n1bRCSB PDB    PDBbind300aa, >4N1B_1|Chains... at 96%
4xmbRCSB PDB    PDBbind289aa, >4XMB_1|Chain... at 100%
5fnrRCSB PDB    PDBbind304aa, >5FNR_1|Chain... at 91%
5fnsRCSB PDB    PDBbind304aa, >5FNS_1|Chain... at 91%
5fntRCSB PDB    PDBbind304aa, >5FNT_1|Chain... at 91%
5fnuRCSB PDB    PDBbind304aa, >5FNU_1|Chain... at 91%
5x54RCSB PDB    PDBbind291aa, >5X54_1|Chains... at 99%
6fmpRCSB PDB    PDBbind414aa, >6FMP_1|Chains... *
6uf0RCSB PDB    PDBbind290aa, >6UF0_1|Chains... at 98%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID5fnq
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameKeap1 Kelch domain
Ligand NameS0W
EC.Number E.C.-.-.-.-
Resolution 1.91(Å)
Affinity (Kd/Ki/IC50)IC50>1000uM
Release Year2016
Protein/NA SequenceCheck fasta file
Primary Reference (2016) J.Med.Chem. Vol. 59: pp. 3991-4006
Ligand Properties
Formula C9H9ClO2
Molecular Weight 184.620
Exact Mass 184.029
No. of atoms 21
No. of bonds 21
Polar Surface Area 37.3
LOGP Value 3.75      (Computed with XLOGP3)
2.36      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 0
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 2
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): Q9Z2X8  
Entrez Gene IDNCBI Entrez Gene ID: 50868  
ASDInformation of known allosteric effects of PDB entries

 
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