Re: [ccp4bb] Dose anyone see this ligand before?

2013-07-16 Thread p...@uni-greifswald.de
Remember, that MPD is chiral, so you have two possibilities at C4.
After putting MPD into your model the FoFc-density should clearly tell
you (your resolution looks better than 2 A), if the group on the left
in your picture is a phosphate / sulfate or if it only has a carbon in
the middle of the tetrahedrally bound atom. Check for hydrogen bonding
partners, which help to identify hydroxy groups. 
greetings
  Gottfried

At Wednesday, 17-07-2013 on 06:14 sonali dhindwal wrote:

hi Wei,

This looks like MPD, 2-Methyl-2,4-pentanediol. May b u have added it
as ur cryo-protectant.

Thanks and Regards
 
-- 
Sonali Dhindwal

“Live as if you were to die tomorrow. Learn as if you were to live
forever.”

-
  From: sonali dhindwal 
To: "ccp4...@hotmail.com"  
Sent: Wednesday, 17 July 2013 9:44 AM
Subject: Re: [ccp4bb] Dose anyone see this ligand before?

hi Wei,

This looks like MPD, 2-Methyl-2,4-pentanediol. May b u have added it
as ur cryo-protectant.

Thanks and Regards

 
-- 
Sonali Dhindwal

“Live as if you were to die tomorrow. Learn as if you were to live
forever.”

-
  From: Wei Feng 
To: CCP4BB@JISCMAIL.AC.UK 
Sent: Tuesday, 16 July 2013 9:05 PM
Subject: [ccp4bb] Dose anyone see this ligand before?

Dear all,
I found some redundant density in my structure beween two molecule.
(see picture 1 and 2)
But I am not sure which ligand will be.
Dose everyone see this ligand before? If so, can you tell the PDB code
or send me the struture file?
Thank you for your time!
Wei




Re: [ccp4bb] practical protocol to remove cell culture derived Threonine from the protein

2012-06-26 Thread p...@uni-greifswald.de


Dear Wenhua, 

  in extension to the post from Herman, you could try to remove the
threonine with a separate enzyme, for instance threonine oxidase or
amino acid deaminase. Their reaction products probably also bind less
tightly. The question is, how fast the release of threonine from your
protein is. 

greetings

  Gottfried

Am Dienstag, dem 26-06-2012 um 11:08 schrieb Wenhua Zhang:

Dear ALL,

The threonine is found in the active site of my protein
structure 
from the crystallization in the absence of any threonine containing 
chemicals. I presume that's why there was no signals detected with the

ITC experiment in which I titrate my protein with Threonine. In the in

vitro biochemical assay, threonine is one of the substrates in the 
reconsitituted system.
So could anyone offer me a practical protocol to remove the 
threonine from the protein for further experiment to confirm the
binding 
of Threonine to my protein by ITC.

   Thank you all.

Wenhua

Ph. D student in structural biology

Paris-Sud XI,  France




Re: [ccp4bb] Fun Question - Is multiple isomorphous replacement an obsolete technique?

2012-06-06 Thread p...@uni-greifswald.de


One could consider RIP (phasing using radiation induced damage) as SIR
technique. At short wavelengths ( Hey!
> 
> I was just wondering, do you know of any recent (~10y) publication
that presented a structure solution solely based on MIR? Without the
use of any anomalous signal of some sort?  
> 
> When was the last time you saw a structure that was solved without
the use of anomalous signal or homology model? Is there a way to look
up the answer (e.g. filter settings in the RCSB) I am not aware of?
> 
> Thanks,
> S.
> 
> (Disclaimer: I am aware that isomorpous data is a valuable source of
information)