Browse entries in the PDBbind-CN Database

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Related entries of code: 3zrk
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1gngRCSB PDB    PDBbind39aa, >1GNG_2|Chains... *
3zrlRCSB PDB    PDBbind32aa, >3ZRL_2|Chains... at 93%
3zrmRCSB PDB    PDBbind32aa, >3ZRM_2|Chains... at 93%
4afjRCSB PDB    PDBbind30aa, >4AFJ_2|Chains... 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 ID3zrk
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameGLYCOGEN SYNTHASE KINASE-3 BETA
Ligand NameZRK
EC.Number E.C.2.7.11.1;2.7.11.26
Resolution 2.37(Å)
Affinity (Kd/Ki/IC50)IC50=0.13uM
Release Year2011
Protein/NA SequenceCheck fasta file
Primary Reference (2011) Bioorg.Med.Chem.Lett. Vol. 21: pp. 4823-4827
Ligand Properties
Formula C12H8N2O2
Molecular Weight 212.204
Exact Mass 212.059
No. of atoms 24
No. of bonds 26
Polar Surface Area 58.89
LOGP Value 1.03      (Computed with XLOGP3)
2.18      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 1
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 3
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): Q92837  P49841  
Entrez Gene IDNCBI Entrez Gene ID: 10023  2932  
ASDInformation of known allosteric effects of PDB entries

 
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