Browse entries in the PDBbind-CN Database

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Related entries of code: 3hxi
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
No similar entries are found!
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
3qx8RCSB PDB    PDBbindGTG
5tefRCSB PDB    PDBbindGTG

Entry Information
PDB ID3hxi
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameSchistsome eIF4E and 4E-BP peptide
Ligand NameGTG
EC.Number E.C.-.-.-.-
Resolution 1.8(Å)
Affinity (Kd/Ki/IC50)Kd=0.47uM
Release Year2009
Protein/NA SequenceCheck fasta file
Primary Reference (2009) J.Biol.Chem. Vol. 284: pp. 31336-31349
Ligand Properties
Formula C21H35N10O18P3
Molecular Weight 808.480
Exact Mass 808.134
No. of atoms 87
No. of bonds 92
Polar Surface Area 472.17
LOGP Value -6.40      (Computed with XLOGP3)
-5.07      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 13
No. of Rotatable Bonds: 16
No. of Nitrogen and Oxygen Atoms: 28
No. of Rings: 6
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): Q13541  
Entrez Gene IDNCBI Entrez Gene ID: 1978  
ASDInformation of known allosteric effects of PDB entries

 
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