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Related entries of code: 1eoc
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
2buvRCSB PDB    PDBbind209aa, >2BUV_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 ID1eoc
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein Nameprotocatechuate 3,4-dioxygenase alpha chain
Ligand Name4NC
EC.Number E.C.1.13.11.3
Resolution 2.25(Å)
Affinity (Kd/Ki/IC50)Ki=0.9uM
Release Year2000
Protein/NA SequenceCheck fasta file
Primary Reference Biochemistry v39 pp. 7943-55, 2000
Ligand Properties
Formula C6H5NO4
Molecular Weight 155.108
Exact Mass 155.022
No. of atoms 16
No. of bonds 16
Polar Surface Area 86.28
LOGP Value 1.04      (Computed with XLOGP3)
1.53      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 2
No. of Nitrogen and Oxygen Atoms: 5
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): P20371  P20372  
Entrez Gene IDNCBI Entrez Gene ID: 45234099  45234098  
ASDInformation of known allosteric effects of PDB entries

 
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