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Related entries of code: 5iu6
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1a69RCSB PDB    PDBbind238aa, >1A69_1|Chains... at 100%
1k9sRCSB PDB    PDBbind237aa, >1K9S_1|Chains... at 100%
1pr1RCSB PDB    PDBbind239aa, >1PR1_1|Chains... *
1pr5RCSB PDB    PDBbind239aa, >1PR5_1|Chains... 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 ID5iu6
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NamePurine nucleoside phosphorylase DeoD-type
Ligand Name7HX
EC.Number E.C.2.4.2.1
Resolution 2.51(Å)
Affinity (Kd/Ki/IC50)Ki=0.13mM
Release Year2017
Protein/NA SequenceCheck fasta file
Primary Reference (2018) Acta Crystallogr F Struct Biol Commun Vol. 74: pp. 355-362
Ligand Properties
Formula C6H5N3O
Molecular Weight 135.123
Exact Mass 135.043
No. of atoms 15
No. of bonds 16
Polar Surface Area 61.54
LOGP Value -0.17      (Computed with XLOGP3)
0.25      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 1
No. of Rotatable Bonds: 0
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 2
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): P0ABP8  
Entrez Gene IDNCBI Entrez Gene ID: 61755373  945654  
ASDInformation of known allosteric effects of PDB entries

 
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