Structure of IDP91546

Crystal structure of streptogramin group A antibiotic acetyltransferase VatA from Staphylococcus aureus in complex with virginiamycin M1

Edit deposit information
CSGID target
IDP91546 
PDB Id
4HUS (NCBI MMDB
Authors
P.J.Stogios,G.Minasov,E.Evdokimova,Z.Wawrzak,V.Yim,M.Krishnamoorthy,R.Di Leo,P.Courvalin,A.Savchenko,W.F.Anderson,Center For Structural Genomics Of Infectious Diseases (Csgid) 
Responsible person
Peter Stogios 
Responsible lab
University of Calgary 
Deposition Date
Nov 03, 2012 
Release Date
Nov 21, 2012 

Annotation

Ligands

Ligand code Name Ligand type
SO4 crystallization
NA Sodium ion crystallization
CL crystallization
EDO crystallization
PEG crystallization
PGE crystallization
175 3,5-dihydro-5-methylidene-4h-imidazol-4-on biological

Structure information

Unit cell parameters

Space Group
C 2 2 21  
Unit Cell

a=93.31Å, b=184.74Å, c=98.57Å
α=90.00, β=90.00, γ=90.00 
Solvent content
 
Matthews coefficient
 

Refinement

Data for the highest resolution shell is in parentheses.
Resolution range
29.39-2.36Å (2.42-2.36Å)  
Rall(%)
18.6 
Rwork(%)
18.4 (21.9) 
Rfree(%)
22.8 (25.7) 
Num. observed reflections
36742 (2578) 
Num. Rfree reflections
1837 (135) 
Completeness(%)
98.8 (1.0) 

Model parameters

Num Atoms
5094  
Num Waters
508  
Num Hetatoms
731  
Model mean isotropic B factor
43.110Å2  
RMSD bond length
0.011Å  
RMSD bond angle
1.238°  
RMSD dihedral angle
15.664°
 
Filename uploaded
4HUS.pdb (uploaded on Nov 21, 2012 3:17 PM)  
Inserted
Nov 05, 2012