Browse entries in the PDBbind-CN Database

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Related entries of code: 6ar9
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
6aqoRCSB PDB    PDBbind272aa, >6AQO_1|Chains... *
6mxdRCSB PDB    PDBbind272aa, >6MXD_1|Chains... at 100%
6mxcRCSB PDB    PDBbind272aa, >6MXC_1|Chains... at 100%
6mxbRCSB PDB    PDBbind272aa, >6MXB_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
4racRCSB PDB    PDBbind3L4
6apvRCSB PDB    PDBbind3L4

Entry Information
PDB ID6ar9
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein Namehypoxanthine-guanine-xanthine PRTase
Ligand Name3L4
EC.Number E.C.-.-.-.-
Resolution 2.28(Å)
Affinity (Kd/Ki/IC50)Ki=6.54uM
Release Year2018
Protein/NA SequenceCheck fasta file
Primary Reference (2018) PLoS Negl Trop Dis Vol. 12: pp. e0006301-e0006301
Ligand Properties
Formula C12H26N6O8P2
Molecular Weight 444.318
Exact Mass 444.129
No. of atoms 54
No. of bonds 55
Polar Surface Area 253.07
LOGP Value -6.17      (Computed with XLOGP3)
-3.96      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 8
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 14
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): Q38CA1  
Entrez Gene IDNCBI Entrez Gene ID: 3662981  
ASDInformation of known allosteric effects of PDB entries

 
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