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PDBsum entry 3npc

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protein ligands Protein-protein interface(s) links
Transferase/transferase inhibitor PDB id
3npc
Jmol
Contents
Protein chains
357 a.a. *
Ligands
B96 ×2
Waters ×290
* Residue conservation analysis
PDB id:
3npc
Name: Transferase/transferase inhibitor
Title: Crystal structure of jnk2 complexed with birb796
Structure: Mitogen-activated protein kinase 9. Chain: a, b. Fragment: unp residues 1-364. Synonym: map kinase 9, mapk 9, stress-activated protein kin c-jun n-terminal kinase 2, jnk-55. Engineered: yes. Mutation: yes
Source: Homo sapiens. Human. Organism_taxid: 9606. Gene: mapk9, jnk2, prkm9. Expressed in: escherichia coli. Expression_system_taxid: 469008.
Resolution:
2.35Å     R-factor:   0.214     R-free:   0.254
Authors: A.Kuglstatter,M.Ghate
Key ref: A.Kuglstatter et al. (2010). X-ray crystal structure of JNK2 complexed with the p38alpha inhibitor BIRB796: insights into the rational design of DFG-out binding MAP kinase inhibitors. Bioorg Med Chem Lett, 20, 5217-5220. PubMed id: 20655210
Date:
28-Jun-10     Release date:   11-Aug-10    
PROCHECK
Go to PROCHECK summary
 Headers
 References

Protein chains
Pfam   ArchSchema ?
P45984  (MK09_HUMAN) -  Mitogen-activated protein kinase 9
Seq:
Struc:
424 a.a.
357 a.a.*
Key:    PfamA domain  Secondary structure  CATH domain
* PDB and UniProt seqs differ at 6 residue positions (black crosses)

 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!
  Biological process     protein phosphorylation   1 term 
  Biochemical function     transferase activity, transferring phosphorus-containing groups     5 terms  

 

 
    reference    
 
 
Bioorg Med Chem Lett 20:5217-5220 (2010)
PubMed id: 20655210  
 
 
X-ray crystal structure of JNK2 complexed with the p38alpha inhibitor BIRB796: insights into the rational design of DFG-out binding MAP kinase inhibitors.
A.Kuglstatter, M.Ghate, S.Tsing, A.G.Villaseñor, D.Shaw, J.W.Barnett, M.F.Browner.
 
  ABSTRACT  
 
No abstract given.