Structure of IDP95645

The structure of condensation and adenylation domains of teixobactin-producing nonribosomal peptide synthetase Txo2 serine module

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CSGID target
IDP95645 
PDB Id
6P1J (NCBI MMDB) 
Authors
K.TAN, M.ZHOU, R.JEDRZEJCZAK, G.BABNIGG,A.JOACHIMIAK,CENTER FOR STRUCTURAL GENOMICS OF INFECTIOUS DISEASES (CSGID)  
Responsible person
Kemin Tan 
Responsible lab
Argonne National Laboratory 
Deposition Date
May 20, 2019 
Release Date
May 29, 2019 

Annotation

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Ligands

Ligand code Name Ligand type
FMT formate crystallization
FLC crystallization
ACT crystallization
CL chloride crystallization
GOL glycerol crystallization
SO4 sulfate crystallization

Structure information

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Unit cell parameters

Space Group
C 2 2 21  
Unit Cell

a=110.86Å, b=399.88Å, c=144.12Å
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
48.48-2.95Å (0.00-0.00Å)  
Rall(%)
22.8 
Rwork(%)
22.6 (0.0) 
Rfree(%)
26.7 (0.0) 
Num. observed reflections
69343 (0) 
Num. Rfree reflections
3397 (0) 
Completeness(%)
97.5 (0.0) 

Model parameters

Num Atoms
14876  
Num Waters
77  
Num Hetatoms
181  
Model mean isotropic B factor
72.900Å2  
RMSD bond length
0.000Å  
RMSD bond angle
0.000°  
Filename uploaded
IDP95645_Txo2_D45_L1005.pdb (uploaded on Aug 04, 2020 4:28 PM)  
Inserted
Aug 04, 2020