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Related entries of code: 1j5i
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1o5pRCSB PDB    PDBbind113aa, >1O5P_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID1j5i
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Nameneocarzinostatin
Ligand NameNCZ
EC.Number E.C.-.-.-.-
Resolution NMR
Affinity (Kd/Ki/IC50)Kd=230uM
Release Year2002
Protein/NA SequenceCheck fasta file
Primary Reference Biochemistry v41 pp. 11731-9, 2002
Ligand Properties
Formula C18H18O6
Molecular Weight 330.332
Exact Mass 330.110
No. of atoms 42
No. of bonds 44
Polar Surface Area 96.22
LOGP Value 2.55      (Computed with XLOGP3)
1.68      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 3
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): P0A3R9  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries

 
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