Browse entries in the PDBbind-CN Database

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Related entries of code: 4zsj
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
4zsgRCSB PDB    PDBbind347aa, >4ZSG_1|Chain... at 100%
4zslRCSB PDB    PDBbind341aa, >4ZSL_1|Chain... at 100%
5byyRCSB PDB    PDBbind346aa, >5BYY_1|Chain... at 100%
5byzRCSB PDB    PDBbind348aa, >5BYZ_1|Chain... at 100%
6hknRCSB PDB    PDBbind340aa, >6HKN_1|Chain... at 100%
6hkmRCSB PDB    PDBbind347aa, >6HKM_1|Chain... at 100%
5o7iRCSB PDB    PDBbind358aa, >5O7I_1|Chain... at 99%
Complexes with the same small molecule ligand
PDB CodeCheck DatabaseLigand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID4zsj
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameMitogen-activated protein kinase 7
Ligand Name4R0
EC.Number E.C.2.7.11.24
Resolution 2.48(Å)
Affinity (Kd/Ki/IC50)IC50=2.3uM
Release Year2016
Protein/NA SequenceCheck fasta file
Primary Reference (2016) Acta Crystallogr D Struct Biol Vol. 72: pp. 682-693
Ligand Properties
Formula C13H17ClN6O
Molecular Weight 308.767
Exact Mass 308.115
No. of atoms 38
No. of bonds 39
Polar Surface Area 97.86
LOGP Value 3.59      (Computed with XLOGP3)
3.58      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 7
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): Q13164  
Entrez Gene IDNCBI Entrez Gene ID: 5598  
ASDInformation of known allosteric effects of PDB entries
 
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