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PDBsum entry 3s42

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protein ligands metals Protein-protein interface(s) links
Lyase PDB id
3s42
Jmol
Contents
Protein chains
260 a.a.
Ligands
MLA ×2
DMS ×6
IMD
BO3
Metals
_NI
Waters ×599
PDB id:
3s42
Name: Lyase
Title: Crystal structure of the 3-dehydroquinate dehydratase (arod) salmonella enterica typhimurium lt2 with malonate and boric the active site
Structure: 3-dehydroquinate dehydratase. Chain: a, b. Synonym: 3-dehydroquinase, type i dhqase. Engineered: yes
Source: Salmonella enterica subsp. Enterica se typhimurium. Organism_taxid: 90371. Strain: lt2. Gene: arod, stm1358. Expressed in: escherichia coli. Expression_system_taxid: 511693.
Resolution:
1.45Å     R-factor:   0.145     R-free:   0.175
Authors: S.H.Light,G.Minasov,M-E.Duban,A.S.Halavaty,S.N.Krishna,L.Shu K.Kwon,W.F.Anderson,Center For Structural Genomics Of Infec Diseases (Csgid)
Key ref: S.H.Light et al. Crystal structure of the 3-Dehydroquinate dehydratase from salmonella enterica typhimurium lt2 with malonat boric acid at the active site. To be published, .
Date:
18-May-11     Release date:   01-Jun-11    
PROCHECK
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 Headers
 References

Protein chains
Pfam   ArchSchema ?
P58687  (AROD_SALTY) -  3-dehydroquinate dehydratase
Seq:
Struc:
252 a.a.
260 a.a.
Key:    PfamA domain  Secondary structure  CATH domain

 Enzyme reactions 
   Enzyme class: E.C.4.2.1.10  - 3-dehydroquinate dehydratase.
[IntEnz]   [ExPASy]   [KEGG]   [BRENDA]

      Pathway:
Shikimate and Chorismate Biosynthesis
      Reaction: 3-dehydroquinate = 3-dehydroshikimate + H2O
3-dehydroquinate
= 3-dehydroshikimate
+ H(2)O
Molecule diagrams generated from .mol files obtained from the KEGG ftp site
 Gene Ontology (GO) functional annotation 
  GO annot!
  Biological process     cellular amino acid biosynthetic process   3 terms 
  Biochemical function     catalytic activity     3 terms