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PDBsum entry 3ocg

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protein ligands links
Transferase/transferase inhibitor PDB id
3ocg
Jmol
Contents
Protein chain
336 a.a. *
Ligands
OCG
Waters ×129
* Residue conservation analysis
PDB id:
3ocg
Name: Transferase/transferase inhibitor
Title: P38 alpha kinase complexed with a 5-amino-pyrazole based inh
Structure: Mitogen-activated protein kinase 14. Chain: a. Synonym: map kinase 14, mapk 14, mitogen-activated protein alpha, map kinase p38 alpha, cytokine suppressive anti-infl drug-binding protein, csaid-binding protein, csbp, max-inte protein 2, map kinase mxi2, sapk2a. Engineered: yes
Source: Homo sapiens. Human. Organism_taxid: 9606. Gene: csbp, csbp1, csbp2, cspb1, mapk14, mxi2. Expressed in: escherichia coli. Expression_system_taxid: 469008. Expression_system_cell_line: bl21(de3).
Resolution:
2.21Å     R-factor:   0.214     R-free:   0.270
Authors: J.S.Sack
Key ref: J.Das et al. (2010). 5-amino-pyrazoles as potent and selective p38α inhibitors. Bioorg Med Chem Lett, 20, 6886-6889. PubMed id: 21035336 DOI: 10.1016/j.bmcl.2010.10.034
Date:
10-Aug-10     Release date:   17-Nov-10    
PROCHECK
Go to PROCHECK summary
 Headers
 References

Protein chain
Pfam   ArchSchema ?
Q16539  (MK14_HUMAN) -  Mitogen-activated protein kinase 14
Seq:
Struc:
360 a.a.
336 a.a.
Key:    PfamA domain  Secondary structure  CATH domain

 Enzyme reactions 
   Enzyme class: E.C.2.7.11.24  - Mitogen-activated protein kinase.
[IntEnz]   [ExPASy]   [KEGG]   [BRENDA]
      Reaction: ATP + a protein = ADP + a phosphoprotein
ATP
+ protein
= ADP
+ phosphoprotein
Molecule diagrams generated from .mol files obtained from the KEGG ftp site
 Gene Ontology (GO) functional annotation 
  GO annot!
  Cellular component     cell   8 terms 
  Biological process     intracellular signal transduction   71 terms 
  Biochemical function     nucleotide binding     11 terms  

 

 
    reference    
 
 
DOI no: 10.1016/j.bmcl.2010.10.034 Bioorg Med Chem Lett 20:6886-6889 (2010)
PubMed id: 21035336  
 
 
5-amino-pyrazoles as potent and selective p38α inhibitors.
J.Das, R.V.Moquin, A.J.Dyckman, T.Li, S.Pitt, R.Zhang, D.R.Shen, K.W.McIntyre, K.Gillooly, A.M.Doweyko, J.A.Newitt, J.S.Sack, H.Zhang, S.E.Kiefer, K.Kish, M.McKinnon, J.C.Barrish, J.H.Dodd, G.L.Schieven, K.Leftheris.
 
  ABSTRACT  
 
No abstract given.