Structure of IDP91135

2.0 Angstrom Crystal Structure of Ligand Binding Component of ABC-type Import System from Staphylococcus aureus with Zinc bound.

Edit deposit information
CSGID target
IDP91135 
PDB Id
3UN6 (NCBI MMDB
Authors
G.Minasov,Z.Wawrzak,A.Halavaty,L.Shuvalova,I.Dubrovska,J.Winsor,O.Kiryukhina,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
Nov 15, 2011 
Release Date
Dec 07, 2011 

Annotation

Ligands

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

Structure information

Unit cell parameters

Space Group
P 1 21 1  
Unit Cell

a=45.08Å, b=64.73Å, c=45.47Å
α=90.00, β=91.50, γ=90.00 
Solvent content
 
Matthews coefficient
 

Refinement

Data for the highest resolution shell is in parentheses.
Resolution range
28.99-2.01Å (2.06-2.00Å)  
Rall(%)
16.6 
Rwork(%)
16.4 (21.3) 
Rfree(%)
20.6 (23.7) 
Num. observed reflections
17049 (1062) 
Num. Rfree reflections
869 (70) 
Completeness(%)
96.7 (80.3) 

Model parameters

Num Atoms
2270  
Num Waters
105  
Num Hetatoms
204  
Model mean isotropic B factor
27.010Å2  
RMSD bond length
0.013Å  
RMSD bond angle
1.424°  
Filename uploaded
rcsb068963.pdb (uploaded on Nov 23, 2011 12:41 PM)  
Inserted
Nov 23, 2011