Structure of IDP91235

Crystal structure of a putative 3-oxoacyl-[acyl-carrier protein]reductase from Escherichia coli strain CFT073 complexed with NADP+ at 2.5 A resolution

Edit deposit information
CSGID target
IDP91235 
PDB Id
4IIV (NCBI MMDB
Authors
J.Hou,T.Osinski,H.Zheng,I.Shumilin,I.Shabalin,S.Shatsman,W.F.Anderson,W.Minor,Center For Structural Genomics Of Infectious Diseases (Csgid) 
Responsible person
Jing Hou 
Responsible lab
University of Virginia 
Deposition Date
Dec 20, 2012 
Release Date
Jan 09, 2013 

Annotation

Description
fabG, catalyzes the first of the two reduction steps in the elongation cycle of fatty acid synthesis using NADP(H) as a cofactor. 
Functional assignment
fatty acid synthesis 

Ligands

Ligand code Name Ligand type
175 3,5-dihydro-5-methylidene-4h-imidazol-4-on biological

Structure information

Unit cell parameters

Space Group
P 65  
Unit Cell

a=127.48Å, b=127.48Å, c=122.95Å
α=90.00, β=90.00, γ=120.00 
Solvent content
 
Matthews coefficient
 

Refinement

Data for the highest resolution shell is in parentheses.
Resolution range
41.76-2.50Å (2.57-2.50Å)  
Rall(%)
18.2 
Rwork(%)
18.0 (21.7) 
Rfree(%)
22.0 (26.0) 
Num. observed reflections
39873 (2058) 
Num. Rfree reflections
1993 (86) 
Completeness(%)
97.2 (71.8) 

Model parameters

Num Atoms
7072  
Num Waters
299  
Num Hetatoms
491  
Model mean isotropic B factor
35.260Å2  
RMSD bond length
0.011Å  
RMSD bond angle
1.510°  
Filename uploaded
4IIV.pdb (uploaded on Jan 09, 2013 1:19 PM)  
Inserted
Jan 09, 2013