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Related entries of code: 1pu8
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1pu7RCSB PDB    PDBbind218aa, >1PU7_1|Chains... *
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID1pu8
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Name3-methyladenine dna glycosylase
Ligand NameEA1
EC.Number E.C.-.-.-.-
Resolution 2.13(Å)
Affinity (Kd/Ki/IC50)Ki=0.8mM
Release Year2003
Protein/NA SequenceCheck fasta file
Primary Reference Embo J. v22 pp. 4898-909, 2003
Ligand Properties
Formula C7H6N5
Molecular Weight 160.156
Exact Mass 160.062
No. of atoms 18
No. of bonds 20
Polar Surface Area 61.46
LOGP Value 1.19      (Computed with XLOGP3)
0.02      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 0
No. of Nitrogen and Oxygen Atoms: 5
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): O25323  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries
 
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