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Related entries of code: 3k02
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
3jzjRCSB PDB    PDBbind409aa, >3JZJ_1|Chain... *
3k00RCSB PDB    PDBbind409aa, >3K00_1|Chain... 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 ID3k02
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein NameAcarbose/maltose binding protein GacH
Ligand NameTXT
EC.Number E.C.-.-.-.-
Resolution 1.55(Å)
Affinity (Kd/Ki/IC50)Kd=10.0uM
Release Year2010
Protein/NA SequenceCheck fasta file
Primary Reference (2010) J.Mol.Biol. Vol. 397: pp. 709-723
Ligand Properties
Formula C31H54NO23
Molecular Weight 808.753
Exact Mass 808.309
No. of atoms 109
No. of bonds 113
Polar Surface Area 404.9
LOGP Value -10.68      (Computed with XLOGP3)
-11.77      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 17
No. of Hydrogen Bond Acceptors: 16
No. of Rotatable Bonds: 28
No. of Nitrogen and Oxygen Atoms: 24
No. of Rings: 5
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): B0B0V1  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries

 
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