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Structure of IDP02609

Crystal Structure of CBS Domain-containing Protein of Unknown Function from Bacillus anthracis str. 'Ames Ancestor'

Edit deposit information
CSGID target
IDP02609 
PDB Id
3LQN (NCBI MMDB
Authors
Y.Kim,R.Mulligan,J.Hasseman,W.F.Anderson,A.Joachimiak,Center For Structural Genomics Of Infectious Diseases (Csgid) 
Responsible person
Youngchang Kim 
Responsible lab
Argonne National Laboratory 
Deposition Date
Feb 09, 2010 
Release Date
Mar 02, 2010 

Annotation

Description
CBS domains are found attached to a number of different other protein domains, in some cases binding to AMP, ADP, ATP, and S-AdoMe, perhaps play a regulatory role making proteins sensitive to adenosyl carrying ligands. The structure consists of αβαββα secondary structure folded to a three-stranded antiparallel β-sheet with two α-helices on one side. CBS domains are always found in pairs in protein sequences and each pair of these domains tightly associate in a pseudo dimeric arrangement through their β-sheets forming a so-called CBS-pair or Bateman domain. 
Functional assignment
 

Ligands

Ligand code Name Ligand type
SO4
FMT
GOL

Structure information

Unit cell parameters

Space Group
C 2 2 21  
Unit Cell

a=27.59Å, b=120.77Å, c=80.03Å
α=90.00, β=90.00, γ=90.00 
Solvent content
37.06  
Matthews coefficient
1.95  

Refinement

Data for the highest resolution shell is in parentheses.
Resolution range
24.40-1.80Å (1.98-1.80Å)  
Rall(%)
18.6 
Rwork(%)
18.4 (19.8) 
Rfree(%)
23.8 (26.4) 
Num. observed reflections
13262 (2973) 
Num. Rfree reflections
652 (136) 
Completeness(%)
98.2 (94.0) 

Model parameters

Num Atoms
1376  
Num Waters
103  
Num Hetatoms
0  
Model mean isotropic B factor
39.600Å2  
RMSD bond length
0.016Å  
RMSD bond angle
1.636°  
RMSD dihedral angle
20.051°
 
Filename uploaded
dep2.pdb (uploaded on Feb 19, 2010 12:58 PM)  
Inserted
Feb 19, 2010