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Structure of IDP00582

Crystal structure of menaquinone-specific isochorismate synthase from Yersinia pestis CO92

Edit deposit information
CSGID target
IDP00582 
PDB Id
3GSE (NCBI MMDB
Authors
B.Nocek,M.Gu,L.Papazisi,W.F.Anderson,A.Joachimiak,Center For Structural Genomics Of Infectious Diseases (Csgid) 
Responsible person
Boguslaw Nocek 
Responsible lab
Argonne National Laboratory 
Deposition Date
Mar 26, 2009 
Release Date
May 05, 2009 

Annotation

Description
MenF is the first enzyme in the menaquinone pathway. It catalyzes the isomerization of chorismate to isochorismate, use in menaquinone biosynthesis. Menaquinone is an electron carrier that is essential for anaerobic electron transport in bacteria. Here, we report crystal structure of MenF, menaquinone-specific isochorismate synthase form Yersinia pestis CO92 to 2.3 A. Crystal structure reveals close fold similarity to structure of MenF from E.coli (2eau).  
Functional assignment
 

Ligands

Ligand code Name Ligand type
SO4

Structure information

Unit cell parameters

Space Group
C 1 2 1  
Unit Cell

a=84.19Å, b=77.00Å, c=70.41Å
α=90.00, β=90.39, γ=90.00 
Solvent content
44.68  
Matthews coefficient
2.22  

Refinement

Data for the highest resolution shell is in parentheses.
Resolution range
30.00-2.28Å (2.34-2.28Å)  
Rall(%)
19.6 
Rwork(%)
19.3 (18.9) 
Rfree(%)
25.2 (33.5) 
Num. observed reflections
20083 (1270) 
Num. Rfree reflections
1024 (59) 
Completeness(%)
97.1 (85.8) 

Model parameters

Num Atoms
3549  
Num Waters
164  
Num Hetatoms
0  
Model mean isotropic B factor
17.690Å2  
RMSD bond length
0.014Å  
RMSD bond angle
1.477°  
Filename uploaded
MOdel-0331-09-fix_refmac3.pdb (uploaded on Apr 02, 2009 11:32 AM)  
Inserted
Apr 02, 2009