Structure of IDP91972

Crystal structure of iron uptake ABC transporter substrate-binding protein PiuA from Streptococcus pneumoniae Canada MDR_19A

Edit deposit information
CSGID target
IDP91972 
PDB Id
4JCC (NCBI MMDB
Authors
P.J.Stogios,Z.Wawrzak,M.Kudritska,V.Yim,A.Savchenko,W.F.Anderson,Center For Structural Genomics Of Infectious Diseases (Csgid) 
Responsible person
Peter Stogios 
Responsible lab
University of Calgary 
Deposition Date
Feb 21, 2013 
Release Date
Mar 06, 2013 

Annotation

Ligands

Ligand code Name Ligand type
SO4 crystallization
IPA crystallization
175 3,5-dihydro-5-methylidene-4h-imidazol-4-on

Structure information

Unit cell parameters

Space Group
P 1 21 1  
Unit Cell

a=52.75Å, b=44.69Å, c=58.79Å
α=90.00, β=106.65, γ=90.00 
Solvent content
 
Matthews coefficient
 

Refinement

Data for the highest resolution shell is in parentheses.
Resolution range
31.52-1.13Å (1.15-1.13Å)  
Rall(%)
14.6 
Rwork(%)
14.5 (20.6) 
Rfree(%)
16.9 (21.7) 
Num. observed reflections
100476 (3073) 
Num. Rfree reflections
5023 (171) 
Completeness(%)
98.2 (96.0) 

Model parameters

Num Atoms
3876  
Num Waters
491  
Num Hetatoms
572  
Model mean isotropic B factor
16.470Å2  
RMSD bond length
0.007Å  
RMSD bond angle
1.192°  
RMSD dihedral angle
10.783°
 
RMSD improper torsion angle
0.007°
 
Filename uploaded
4JCC.pdb (uploaded on Mar 06, 2013 10:02 AM)  
Inserted
Feb 25, 2013