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Related entries of code: 2no3
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB CodeCheck DatabaseProtein Sequence Similarity
1ukhRCSB PDB    PDBbind11aa, >1UKH:B|PDBID|CHAIN|... *
2g01RCSB PDB    PDBbind11aa, >2G01:G|PDBID|CHAIN|... at 100%
2gmxRCSB PDB    PDBbind11aa, >2GMX:G|PDBID|CHAIN|... at 100%
2h96RCSB PDB    PDBbind11aa, >2H96:G|PDBID|CHAIN|... at 100%
3ptgRCSB PDB    PDBbind11aa, >3PTG:J|PDBID|CHAIN|... at 100%
3v3vRCSB PDB    PDBbind11aa, >3V3V:B|PDBID|CHAIN|... at 100%
4hysRCSB PDB    PDBbind11aa, >4HYS:B|PDBID|CHAIN|... at 100%
4hyuRCSB PDB    PDBbind11aa, >4HYU:B|PDBID|CHAIN|... at 100%
4izyRCSB PDB    PDBbind11aa, >4IZY:B|PDBID|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 ID2no3
Complex TypeProtein-Ligand
PDBbind Subsetgeneral set
Protein NameMitogen-activated protein kinase 8(JNK-1)
Ligand Name859
EC.Number E.C.2.7.11.24
Resolution 3.2(Å)
Affinity (Kd/Ki/IC50)IC50=9nM
Release Year2007
Protein/NA SequenceCheck fasta file
Primary ReferenceBioorg. Med. Chem. Lett. 2007, 17, 668-672.
Ligand Properties
Formula C17H15N5O2
Molecular Weight 321.333
Exact Mass 321.123
No. of atoms 39
No. of bonds 41
Polar Surface Area 113.16
LOGP Value 3.03      (Computed with XLOGP3)
3.61      (Computed with Open Babel)
Drug likenessNo. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 7
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): P45983  
Entrez Gene IDNCBI Entrez Gene ID: 5599  
ASDInformation of known allosteric effects of PDB entries

 
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