Shankar,

It looks like Acetyl coA to me.

Best wishes,

- Allister


> On 10 Jan 2018, at 04:09, Shankar Prasad Kanaujia <spkanau...@gmail.com> 
> wrote:
> 
> Dear All,
> 
> Wishing you all a very happy and prosperous new year 2018....
> 
> We have recently solved a structure which contains a huge density in the 
> active site. We modelled a molecule fitting the electron density (please see 
> the attached figures). However, we could not find any known molecule similar 
> to the fitted molecule either in PDB or PubChem databases. Thus, we are not 
> able to correlate its existence in cell.
> 
> The protein was expressed in E. coli cells. The structure is solved at 1.85 
> Angst. We have not added any molecule like this in any step of the 
> experiments.
> 
> Looking forward to having some ways to figure out this problem.
> 
> With best regards,
> Shankar
> <ligand1_density.png>
> 
> -- 
> Shankar Prasad Kanaujia, Ph.D.
> Associate Professor
> Department of Biosciences and Bioengineering
> Indian Institute of Technology Guwahati
> Guwahati - 781039 Assam, India
> Tele: 0361 258 2228
> Fax:  0361 258 2249
> Email: spkanau...@iitg.ernet.in <mailto:spkanau...@iitg.ernet.in>
> Homepage: http://www.iitg.ernet.in/spkanaujia/ 
> <http://www.iitg.ernet.in/spkanaujia/>
> Google Scholar: https://scholar.google.com/citations?user=Zt4JSNYAAAAJ&hl=en 
> <https://scholar.google.com/citations?user=Zt4JSNYAAAAJ&hl=en>
> <ligand1.png>

-----------------
Allister Crow
School of Life Sciences
University of Warwick






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