Structure of IDP96979

Thiol-disulfide oxidoreductase TsdA, C129S mutant, from Corynebacterium diphtheriae

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CSGID target
IDP96979 
PDB Id
7UNO (NCBI MMDB) 
Authors
J.Osipiuk, M. Reardon-Robinson, M.T. Nguyen, B.Sanchez, H.Ton-That, A.Joachimiak 
Responsible person
Jerzy Osipiuk 
Responsible lab
Argonne National Laboratory 
Deposition Date
Apr 11, 2022 
Release Date
 

Annotation

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Ligands

Ligand code Name Ligand type
CL chloride crystallization
PGE crystallization
EDO ethylene diol crystallization

Structure information

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Unit cell parameters

Space Group
P 21 21 21  
Unit Cell

a=52.81Å, b=65.11Å, c=69.42Å
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
47.49-1.10Å (1.13-1.10Å)  
Rall(%)
11.7 
Rwork(%)
11.6 (31.7) 
Rfree(%)
13.4 (31.5) 
Num. observed reflections
95769 (5863) 
Num. Rfree reflections
4692 (304) 
Completeness(%)
98.1 (82.4) 

Model parameters

Num Atoms
2067  
Num Waters
415  
Num Hetatoms
431  
Model mean isotropic B factor
14.870Å2  
RMSD bond length
0.010Å  
RMSD bond angle
1.592°  
Filename uploaded
TsdA_C129S_fin.pdb (uploaded on Apr 12, 2022 2:00 PM)  
Inserted
Apr 12, 2022