Browse entries in the PDBbind-CN Database

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Related entries of code: 2csn
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
3q2jRCSB PDB    PDBbindCKI
3q2mRCSB PDB    PDBbindCKI
4xhlRCSB PDB    PDBbindCKI

Entry Information
PDB ID2csn
Complex TypeProtein-Ligand
PDBbind Subsetrefined set
Protein Namecasein kinase-1
Ligand NameCKI
EC.Number E.C.2.7.1.-
Resolution 2.5(Å)
Affinity (Kd/Ki/IC50)Ki=39uM
Release Year1996
Protein/NA SequenceCheck fasta file
Primary Reference Proc.Natl.Acad.Sci.USA v93 pp. 6308-13, 1996
Ligand Properties
Formula C11H13ClN3O2S
Molecular Weight 286.758
Exact Mass 286.042
No. of atoms 31
No. of bonds 32
Polar Surface Area 95.08
LOGP Value 0.75      (Computed with XLOGP3)
1.88      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 4
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 2
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): P40233  
Entrez Gene IDNo matched NCBI Entrez Gene ID found!
ASDInformation of known allosteric effects of PDB entries

 
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