Structure of IDP90781

Crystal Structure of the Catalytic Domain of the Inosine Monophosphate Dehydrogenase from Campylobacter jejuni in the complex with inhibitor p176

Edit deposit information
CSGID target
IDP90781 
PDB Id
5URQ (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 12, 2017 
Release Date
Mar 01, 2017 

Annotation

Ligands

Ligand code Name Ligand type
IMP biological
176 biological
K biological

Structure information

Unit cell parameters

Space Group
P 1 21 1  
Unit Cell

a=98.49Å, b=141.79Å, c=121.64Å
α=90.00, β=94.47, γ=90.00 
Solvent content
 
Matthews coefficient
 

Refinement

Data for the highest resolution shell is in parentheses.
Resolution range
40.80-2.68Å (2.71-2.68Å)  
Rall(%)
18.3 
Rwork(%)
18.0 (30.7) 
Rfree(%)
23.5 (37.3) 
Num. observed reflections
95697 (1923) 
Num. Rfree reflections
4727 (103) 
Completeness(%)
97.8 (62.0) 

Model parameters

Num Atoms
21416  
Num Waters
17  
Num Hetatoms
209  
Model mean isotropic B factor
64.230Å2  
RMSD bond length
0.008Å  
RMSD bond angle
1.101°  
RMSD dihedral angle
17.331°
 
Filename uploaded
dep.pdb (uploaded on Mar 01, 2017 7:39 AM)  
Inserted
Mar 01, 2017