Browse entries in the PDBbind-CN Database

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Related entries of code: 3bxe
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3bxfRCSB PDB    PDBbind255aa, >3BXF_1|Chains... at 100%
3bxgRCSB PDB    PDBbind255aa, >3BXG_1|Chains... at 100%
3bxhRCSB PDB    PDBbind255aa, >3BXH_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
1adoRCSB PDB    PDBbind13P
3t2cRCSB PDB    PDBbind13P

Entry Information
PDB ID3bxe
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NameC-terminal effector-binding domain of CggR
Ligand Name13P
EC.Number E.C.-.-.-.-
Resolution 1.8(Å)
Affinity (Kd/Ki/IC50)Kd=3.34uM
Release Year2008
Protein/NA SequenceCheck fasta file
Primary Reference (2008) Mol.Microbiol. Vol. 69: pp. 895-910
Ligand Properties
Formula C3H8O6P
Molecular Weight 171.066
Exact Mass 171.006
No. of atoms 18
No. of bonds 17
Polar Surface Area 120.81
LOGP Value -2.62      (Computed with XLOGP3)
-1.78      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 0
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): O32253  
Entrez Gene IDNCBI Entrez Gene ID: 938570  
ASDInformation of known allosteric effects of PDB entries

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