Structure of IDP91646

Crystal Structure of the Catalytic Domain of the Inosine Monophosphate De- hydrogenase from Mycobacterium tuberculosis in the complex with IMP and the inhibitor P41

Edit deposit information
CSGID target
IDP91646 
PDB Id
4ZQN (NCBI MMDB
Authors
Y.Kim,M.Makowska-Grzyska,M.Gu,M.Kavitha,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
May 10, 2015 
Release Date
Jun 17, 2015 

Annotation

Ligands

Ligand code Name Ligand type
P41 biological
IMP biological

Structure information

Unit cell parameters

Space Group
I 4  
Unit Cell

a=87.94Å, b=87.94Å, c=84.76Å
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
35.67-2.00Å (2.09-2.00Å)  
Rall(%)
18.0 
Rwork(%)
17.8 (28.2) 
Rfree(%)
22.1 (33.8) 
Num. observed reflections
22480 (2328) 
Num. Rfree reflections
1146 (109) 
Completeness(%)
97.4 (85.0) 

Model parameters

Num Atoms
2578  
Num Waters
118  
Num Hetatoms
118  
Model mean isotropic B factor
51.810Å2  
RMSD bond length
0.007Å  
RMSD bond angle
1.209°  
RMSD dihedral angle
14.71°
 
Filename uploaded
dep-nn.pdb (uploaded on Aug 10, 2015 6:53 PM)  
Inserted
Aug 10, 2015