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Related entries of code: 4otg
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
4othRCSB PDB    PDBbind341aa, >4OTH_1|Chain... at 100%
4otiRCSB PDB    PDBbind341aa, >4OTI_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 ID4otg
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameSerine/threonine-protein kinase N1 PRK1
Ligand Name2V9
EC.Number E.C.2.7.11.13
Resolution 2.6(Å)
Affinity (Kd/Ki/IC50)IC50=26nM
Release Year2014
Protein/NA SequenceCheck fasta file
Primary Reference (2014) Plos One Vol. 9. e103638: pp.1-7
Ligand Properties
Formula C26H21N3O4
Molecular Weight 439.463
Exact Mass 439.153
No. of atoms 54
No. of bonds 61
Polar Surface Area 88.65
LOGP Value 2.20      (Computed with XLOGP3)
3.80      (Computed with Open Babel)
Drug likeness No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 8
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): Q16512  
Entrez Gene IDNCBI Entrez Gene ID: 5585  
ASDInformation of known allosteric effects of PDB entries

 
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