Structure of IDP90781

Crystal Structure of the Catalytic Domain of the Inosine Monophosphate Dehydrogenase from Campylobacter jejuni in the complex with inhibitor p182

Edit deposit information
CSGID target
IDP90781 
PDB Id
5UQH (NCBI MMDB
Authors
Y.Kim,N.Maltseva,M.Makowska-Grzyska,M.Gu,D.Gollapalli,L.Hedstrom,W.F.Anderson,A.Joachimiak,Center For Structural Genomics Of Infectious Diseases (Csgid) 
Responsible person
Youngchang Kim 
Responsible lab
Argonne National Laboratory 
Deposition Date
Feb 08, 2017 
Release Date
Mar 01, 2017 

Annotation

Ligands

Ligand code Name Ligand type
IMP biological
P18 biological
K biological
EDO crystallization
IPA crystallization

Structure information

Unit cell parameters

Space Group
P 1 21 1  
Unit Cell

a=98.44Å, b=141.28Å, c=121.06Å
α=90.00, β=94.36, γ=90.00 
Solvent content
 
Matthews coefficient
 

Refinement

Data for the highest resolution shell is in parentheses.
Resolution range
46.72-2.20Å (2.23-2.20Å)  
Rall(%)
17.4 
Rwork(%)
17.1 (23.5) 
Rfree(%)
21.3 (31.5) 
Num. observed reflections
158125 (1667) 
Num. Rfree reflections
7795 (77) 
Completeness(%)
90.4 (38.0) 

Model parameters

Num Atoms
21568  
Num Waters
593  
Num Hetatoms
809  
Model mean isotropic B factor
39.510Å2  
RMSD bond length
0.003Å  
RMSD bond angle
0.855°  
RMSD dihedral angle
19.139°
 
Filename uploaded
dep.pdb (uploaded on Mar 01, 2017 7:46 AM)  
Inserted
Mar 01, 2017