Structure of IDP91646

Crystal Structure of the Catalytic Domain of the Inosine Monophosphate Dehydrogenase from Mycobacterium tuberculosis In the presence of G36

Edit deposit information
CSGID target
IDP91646 
PDB Id
5UPV (NCBI MMDB
Authors
Y.Kim,N.Maltseva,R.Mulligan,M.Makowska-Grzyska,M.Gu,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 04, 2017 
Release Date
Feb 22, 2017 

Annotation

Ligands

Ligand code Name Ligand type
IMP biological
G36 o6-ethyl-2'-deoxyguanosine-5'-monophosphate biological
FMT crystallization
EDO crystallization

Structure information

Unit cell parameters

Space Group
I 4  
Unit Cell

a=88.13Å, b=88.13Å, c=84.36Å
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
35.71-1.63Å (1.67-1.63Å)  
Rall(%)
16.4 
Rwork(%)
16.3 (30.8) 
Rfree(%)
18.4 (33.5) 
Num. observed reflections
40897 (2511) 
Num. Rfree reflections
1954 (130) 
Completeness(%)
97.1 (81.0) 

Model parameters

Num Atoms
2534  
Num Waters
159  
Num Hetatoms
228  
Model mean isotropic B factor
36.590Å2  
RMSD bond length
0.006Å  
RMSD bond angle
0.895°  
RMSD dihedral angle
11.24°
 
Filename uploaded
dep.pdb (uploaded on Feb 15, 2017 5:20 PM)  
Inserted
Feb 15, 2017