Structure of IDP91106

1.98 Angstrom Crystal Structure of Putative 5''-Nucleotidase from Staphylococcus aureus in complex with Adenosine.

Edit deposit information
CSGID target
IDP91106 
PDB Id
4Q7F (NCBI MMDB
Authors
G.Minasov,S.Nocadello,L.Shuvalova,I.Dubrovska,J.Winsor,F.Bagnoli,F.Falugi,M.Bottomley,G.Grandi,W.F.Anderson,Center For Structural Genomics Of Infectious Diseases (Csgid) 
Responsible person
George Minasov 
Responsible lab
Northwestern University 
Deposition Date
Apr 24, 2014 
Release Date
May 07, 2014 

Annotation

Ligands

Ligand code Name Ligand type
MG biological
MN unknown biological
3D1 (2r,3s,5r)-5-(6-amino-9h-purin-9-yl)-tetrahydro-2-(hydr oxymethyl)furan-3-ol biological
175 3,5-dihydro-5-methylidene-4h-imidazol-4-on

Structure information

Unit cell parameters

Space Group
C 1 2 1  
Unit Cell

a=89.58Å, b=86.45Å, c=95.65Å
α=90.00, β=116.86, γ=90.00 
Solvent content
 
Matthews coefficient
 

Refinement

Data for the highest resolution shell is in parentheses.
Resolution range
29.36-1.98Å (2.03-1.98Å)  
Rall(%)
18.8 
Rwork(%)
18.7 (32.6) 
Rfree(%)
21.8 (37.1) 
Num. observed reflections
44445 (3253) 
Num. Rfree reflections
2222 (180) 
Completeness(%)
98.0 (97.1) 

Model parameters

Num Atoms
4124  
Num Waters
380  
Num Hetatoms
505  
Model mean isotropic B factor
31.590Å2  
RMSD bond length
0.009Å  
RMSD bond angle
1.493°  
Filename uploaded
4Q7F.pdb (uploaded on Aug 27, 2014 4:21 PM)  
Inserted
Aug 27, 2014