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Structure of IDP02729

Crystal structure of the Bacillus anthracis acetyl-CoA acetyltransferase

Edit deposit information
CSGID target
IDP02729 
PDB Id
3SS6 (NCBI MMDB
Authors
S.M.Anderson,Z.Wawrzak,O.Onopriyenko,S.N.Peterson,W.F.Anderson,A.Savchenko,Center For Structural Genomics Of Infectious Diseases (Csgid) 
Responsible person
Spencer Anderson 
Responsible lab
Northwestern University 
Deposition Date
Jul 07, 2011 
Release Date
Jul 15, 2011 

Annotation

Ligands

Ligand code Name Ligand type
SO4 crystallization
CSO s-hydroxycysteine biological
175 3,5-dihydro-5-methylidene-4h-imidazol-4-on

Structure information

Unit cell parameters

Space Group
P 31 2 1  
Unit Cell

a=94.72Å, b=94.72Å, c=189.26Å
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
34.40-1.70Å (1.76-1.70Å)  
Rall(%)
15.3 
Rwork(%)
15.2 (22.4) 
Rfree(%)
17.5 (25.7) 
Num. observed reflections
113063 (10057) 
Num. Rfree reflections
5653 (520) 
Completeness(%)
99.7 (98.7) 

Model parameters

Num Atoms
5970  
Num Waters
1021  
Num Hetatoms
1105  
Model mean isotropic B factor
25.520Å2  
RMSD bond length
0.007Å  
RMSD bond angle
1.198°  
RMSD dihedral angle
14.49°
 
Filename uploaded
rcsb066585.pdb (uploaded on Jul 14, 2011 2:11 PM)  
Inserted
Jul 14, 2011