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Structure of IDP02573

Crystal structure of a putative 3-oxoacyl-(acyl carrier protein) reductase from Bacillus anthracis at 1.87 A resolution

Edit deposit information
CSGID target
IDP02573 
PDB Id
3ICC (NCBI MMDB
Authors
J.Hou,M.Chruszcz,H.Zheng,M.Cymborowski,H.-B.Luo,T.Skarina,S.Gordon,A.Savchenko,A.M.Edwards,W.Anderson,W.Minor,Center For Structural Genomics Of Infectious Diseases (Csgid) 
Responsible person
Jing Hou 
Responsible lab
University of Virginia 
Deposition Date
Jul 17, 2009 
Release Date
Jul 28, 2009 

Annotation

Ligands

Ligand code Name Ligand type
SO4
MES 2-(n-morpholino)-ethanesulfonic acid
CL CHLORIDE ION
H01 protoporphyrin ix 2,4-disulfonic acid
MSE modified residue

Structure information

Unit cell parameters

Space Group
C 2 2 21  
Unit Cell

a=98.73Å, b=104.83Å, c=103.68Å
α=90.00, β=90.00, γ=90.00 
Solvent content
49.33  
Matthews coefficient
2.43  

Refinement

Data for the highest resolution shell is in parentheses.
Resolution range
50.00-1.87Å (1.92-1.87Å)  
Rall(%)
16.8 
Rwork(%)
16.6 (21.5) 
Rfree(%)
20.7 (26.6) 
Num. observed reflections
44157 (2735) 
Num. Rfree reflections
2207 (130) 
Completeness(%)
98.8 (83.8) 

Model parameters

Num Atoms
4279  
Num Waters
288  
Num Hetatoms
0  
Model mean isotropic B factor
13.380Å2  
RMSD bond length
0.016Å  
RMSD bond angle
1.557°  
Filename uploaded
hkl_refine_67.pdb (uploaded on Jul 17, 2009 1:47 PM)  
Inserted
Jul 17, 2009