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PDBsum entry 4zwl

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protein ligands Protein-protein interface(s) links
Oxidoreductase PDB id
4zwl

 

 

 

 

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Contents
Protein chains
(+ 2 more) 499 a.a.
Ligands
NAD ×8
SO4 ×15
Waters ×1204
PDB id:
4zwl
Name: Oxidoreductase
Title: 2.60 angstrom resolution crystal structure of betaine aldehyde dehydrogenase (betb) h448f/y450l double mutant from staphylococcus aureus in complex with NAD+ and bme-free cys289
Structure: Betaine-aldehyde dehydrogenase. Chain: a, b, c, d, e, f, g, h. Engineered: yes. Mutation: yes
Source: Staphylococcus aureus (strain col). Organism_taxid: 93062. Strain: col. Gene: betb, sacol2628. Expressed in: escherichia coli bl21(de3). Expression_system_taxid: 469008.
Resolution:
2.60Å     R-factor:   0.162     R-free:   0.232
Authors: A.S.Halavaty,G.Minasov,C.Chen,J.C.Joo,A.F.Yakunin,W.F.Anderson,Center For Structural Genomics Of Infectious Diseases (Csgid)
Key ref: A.S.Halavaty et al. 2.60 angstrom resolution crystal structure of betaine aldehyde dehydrogenase (betb) h448f/y450l double muta staphylococcus aureus in complex with NAD+ and bme-Fr cys289. To be published, .
Date:
19-May-15     Release date:   27-May-15    
PROCHECK
Go to PROCHECK summary
 Headers
 References

Protein chains
Pfam   ArchSchema ?
A0A0M3KL40  (A0A0M3KL40_STAAC) -  Betaine-aldehyde dehydrogenase from Staphylococcus aureus (strain COL)
Seq:
Struc:
496 a.a.
499 a.a.
Key:    PfamA domain  Secondary structure  CATH domain

 Enzyme reactions 
   Enzyme class: E.C.1.2.1.8  - betaine-aldehyde dehydrogenase.
[IntEnz]   [ExPASy]   [KEGG]   [BRENDA]
      Reaction: betaine aldehyde + NAD+ + H2O = glycine betaine + NADH + 2 H+
betaine aldehyde
+ NAD(+)
+ H2O
Bound ligand (Het Group name = NAD)
corresponds exactly
= glycine betaine
+ NADH
+ 2 × H(+)
Molecule diagrams generated from .mol files obtained from the KEGG ftp site

 

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