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Related entries of code: 4r74
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
4r73RCSB PDB    PDBbind321aa, >4R73_1|Chains... *
4r75RCSB PDB    PDBbind321aa, >4R75_1|Chain... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1mtoRCSB PDB    PDBbindF6P
3bxhRCSB PDB    PDBbindF6P
3n1cRCSB PDB    PDBbindF6P

Entry Information
PDB ID4r74
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein Nameperiplasmic binding protein AfuA from Actinobacillus pleuropneumoniae
Ligand NameF6P
EC.Number E.C.-.-.-.-
Resolution 1.93(Å)
Affinity (Kd/Ki/IC50)Kd=8nM
Release Year2015
Protein/NA SequenceCheck fasta file
Primary Reference (2015) Plos Pathog. Vol. 11: pp. e1005107-e1005107
Ligand Properties
Formula C6H14O9P
Molecular Weight 261.144
Exact Mass 261.038
No. of atoms 30
No. of bonds 30
Polar Surface Area 173.66
LOGP Value -4.09      (Computed with XLOGP3)
-3.54      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 7
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 9
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): A3N294  
Entrez Gene IDNCBI Entrez Gene ID: 48599661  
ASDInformation of known allosteric effects of PDB entries

 
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