Structure of IDP90781

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

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CSGID target
IDP90781 
PDB Id
6MGR (NCBI MMDB) 
Authors
'Y.Kim,N.Maltseva,R.Yu,L.Hedstrom,A.Joachimiak,Center For Structural Genomics Of Infectious Diseases (Csgid)' 
Responsible person
Youngchang Kim 
Responsible lab
Argonne National Laboratory 
Deposition Date
Sep 14, 2018 
Release Date
Oct 24, 2018 

Annotation

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Ligands

Ligand code Name Ligand type
OXP 2-oxo-3-pentenoic acid biological
K biological
SO4 sulfate crystallization
CL chloride crystallization
MPD unknown crystallization

Structure information

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Unit cell parameters

Space Group
P 1 21 1  
Unit Cell

a=69.34Å, b=119.59Å, c=119.31Å
α=90.00, β=89.99, γ=90.00 
Solvent content
 
Matthews coefficient
 

Refinement

Data for the highest resolution shell is in parentheses.
Resolution range
45.28-1.97Å (1.99-1.97Å)  
Rall(%)
17.5 
Rwork(%)
17.3 (36.0) 
Rfree(%)
20.2 (41.7) 
Num. observed reflections
140931 (3366) 
Num. Rfree reflections
6821 (164) 
Completeness(%)
97.4 (74.0) 

Model parameters

Num Atoms
11050  
Num Waters
428  
Num Hetatoms
552  
Model mean isotropic B factor
61.470Å2  
RMSD bond length
0.007Å  
RMSD bond angle
0.960°  
RMSD dihedral angle
16.31°
 
Filename uploaded
dep.pdb (uploaded on Dec 06, 2018 12:34 PM)  
Inserted
Dec 06, 2018