Structure of IDP91101

1.9 Angstrom Crystal Structure of Superantigen-like Protein, Exotoxin from Staphylococcus aureus, in Complex with Sialyl-LewisX.

Edit deposit information
CSGID target
IDP91101 
PDB Id
4RCO (NCBI MMDB
Authors
G.Minasov,S.Nocadello,L.Shuvalova,E.Filippova,A.Halavaty,I.Dubrovska,K.Flores,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
Sep 16, 2014 
Release Date
Oct 01, 2014 

Annotation

Ligands

Ligand code Name Ligand type
FUC alpha-l-fucose biological
GAL beta-d-galactose biological
SIA o-sialic acid biological
CL crystallization
175 3,5-dihydro-5-methylidene-4h-imidazol-4-on

Structure information

Unit cell parameters

Space Group
P 21 21 21  
Unit Cell

a=33.98Å, b=88.90Å, c=153.84Å
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
29.10-1.90Å (1.95-1.90Å)  
Rall(%)
17.4 
Rwork(%)
17.2 (23.1) 
Rfree(%)
21.4 (27.6) 
Num. observed reflections
37679 (2669) 
Num. Rfree reflections
1883 (126) 
Completeness(%)
99.7 (100.0) 

Model parameters

Num Atoms
3321  
Num Waters
465  
Num Hetatoms
595  
Model mean isotropic B factor
37.690Å2  
RMSD bond length
0.010Å  
RMSD bond angle
1.529°  
Filename uploaded
4RCO.pdb (uploaded on Oct 09, 2014 12:36 PM)  
Inserted
Oct 09, 2014