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Related entries of code: 4ez5
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
4auaRCSB PDB    PDBbind307aa, >4AUA_1|Chain... at 98%
5l2iRCSB PDB    PDBbind307aa, >5L2I_1|Chain... at 98%
5l2sRCSB PDB    PDBbind307aa, >5L2S_1|Chain... at 98%
5l2tRCSB PDB    PDBbind307aa, >5L2T_1|Chain... at 98%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!

Entry Information
PDB ID4ez5
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameCyclin-dependent kinase 6
Ligand Name0RS
EC.Number E.C.
Resolution 2.7(Å)
Affinity (Kd/Ki/IC50)IC50=0.3uM
Release Year2013
Protein/NA SequenceCheck fasta file
Primary Reference (2012) ACS MED.CHEM.LETT. Vol. 3: pp. 445-449
Ligand Properties
Formula C28H28N7O
Molecular Weight 478.568
Exact Mass 478.236
No. of atoms 64
No. of bonds 69
Polar Surface Area 92.1
LOGP Value 4.25      (Computed with XLOGP3)
2.98      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 8
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): Q00534  
Entrez Gene IDNCBI Entrez Gene ID: 1021  
ASDInformation of known allosteric effects of PDB entries

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