Structure of IDP01493

Crystal Structure of Beta-ketoacyl-ACP synthase III-2 (FabH2) (C113A) from Vibrio Cholerae co-crystallized with octanoyl-CoA

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CSGID target
IDP01493 
PDB Id
5V0P (NCBI MMDB) 
Authors
'J.Hou,H.Zheng,D.R.Cooper,M.Grabowski,W.F.Anderson,W.Minor,Center For Structural Genomics Of Infectious Diseases (Csgid)' 
Responsible person
Heping Zheng 
Responsible lab
University of Virginia 
Deposition Date
Feb 28, 2017 
Release Date
Mar 22, 2017 

Annotation

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Ligands

Ligand code Name Ligand type
NA crystallization
CO8 octanoyl-coenzyme a biological

Structure information

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Unit cell parameters

Space Group
P 1 21 1  
Unit Cell

a=85.32Å, b=61.89Å, c=75.73Å
α=90.00, β=93.18, γ=90.00 
Solvent content
 
Matthews coefficient
 

Refinement

Data for the highest resolution shell is in parentheses.
Resolution range
50.01-2.16Å (2.22-2.16Å)  
Rall(%)
17.5 
Rwork(%)
17.4 (17.6) 
Rfree(%)
20.7 (22.0) 
Num. observed reflections
42262 (3101) 
Num. Rfree reflections
2028 (146) 
Completeness(%)
99.2 (98.6) 

Model parameters

Num Atoms
5348  
Num Waters
345  
Num Hetatoms
461  
Model mean isotropic B factor
41.070Å2  
RMSD bond length
0.009Å  
RMSD bond angle
1.420°  
Filename uploaded
hkl_refine_40.pdb_tls (uploaded on Feb 28, 2017 4:54 PM)  
Inserted
Feb 28, 2017