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PDBsum entry 3oqf

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protein ligands Protein-protein interface(s) links
Hydrolase PDB id
3oqf
Jmol
Contents
Protein chain
337 a.a. *
Ligands
NAG ×2
S51 ×2
Waters ×195
* Residue conservation analysis
PDB id:
3oqf
Name: Hydrolase
Title: Crystal structure analysis of renin-indole-piperazine inhibi complexes
Structure: Renin. Chain: a, b. Fragment: unp residues 67-406. Synonym: angiotensinogenase. Engineered: yes
Source: Homo sapiens. Human. Organism_taxid: 9606. Gene: ren. Expressed in: homo sapiens. Expression_system_taxid: 9606. Expression_system_cell_line: human embryonic kidney cell (c
Resolution:
2.78Å     R-factor:   0.181     R-free:   0.201
Authors: Z.Bocskei
Key ref: B.Scheiper et al. (2010). Discovery and optimization of a new class of potent and non-chiral indole-3-carboxamide-based renin inhibitors. Bioorg Med Chem Lett, 20, 6268-6272. PubMed id: 20850300 DOI: 10.1016/j.bmcl.2010.08.092
Date:
03-Sep-10     Release date:   13-Oct-10    
PROCHECK
Go to PROCHECK summary
 Headers
 References

Protein chains
Pfam   ArchSchema ?
P00797  (RENI_HUMAN) -  Renin
Seq:
Struc:
406 a.a.
337 a.a.
Key:    PfamA domain  Secondary structure  CATH domain

 Enzyme reactions 
   Enzyme class: E.C.3.4.23.15  - Renin.
[IntEnz]   [ExPASy]   [KEGG]   [BRENDA]
      Reaction: Cleaves Leu-|- bond in angiotensinogen to generate angiotensin I.
 Gene Ontology (GO) functional annotation 
  GO annot!
  Biological process     proteolysis   1 term 
  Biochemical function     aspartic-type endopeptidase activity     1 term  

 

 
DOI no: 10.1016/j.bmcl.2010.08.092 Bioorg Med Chem Lett 20:6268-6272 (2010)
PubMed id: 20850300  
 
 
Discovery and optimization of a new class of potent and non-chiral indole-3-carboxamide-based renin inhibitors.
B.Scheiper, H.Matter, H.Steinhagen, U.Stilz, Z.Böcskei, V.Fleury, G.McCort.
 
  ABSTRACT  
 
No abstract given.

 

Literature references that cite this PDB file's key reference

  PubMed id Reference
21429746 R.Aspiotis, A.Chen, E.Cauchon, D.Dubé, J.P.Falgueyret, S.Gagné, M.Gallant, E.L.Grimm, R.Houle, H.Juteau, P.Lacombe, S.Laliberté, J.F.Lévesque, D.MacDonald, D.McKay, M.D.Percival, P.Roy, S.M.Soisson, and T.Wu (2011).
The discovery and synthesis of potent zwitterionic inhibitors of renin.
  Bioorg Med Chem Lett, 21, 2430-2436.  
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