Dear All,

Here I make my question much clear.


For both PDB 2zan and 2zam, they are for the same protein, they conformation 
were similar except that 2zam was apo and 2zam was ATP binding. 2zaz was got by 
soaking the 2zam crystal with ATP. Both were P65 space group


However by getting the mate coordinates of 2zam and 2zan by Coot or Chimera, 
you will find their 6 mates arrange differently ( viewed by Chimera or by 
Pymol). For 2zan, the 6 mates were separated with each other, but for 2zam the 
6 mates were connected. Can you explain to me why  their 6 mates arrange 
differently?


What is more, by pymol I align 2zan onto 2zam, and I get the PDB for 2zan 
fitted to 2zam (no any text information from the pdb file left after pymol 
saving, except the coordinates). Then I add all the text information from 2zan 
(except the coordinates) to the PDB for 2zan fitted to 2zam, and then I get the 
mate coordinates by Chimera or Coort and then view the mates got by Chimera or 
Coot for the text information added PDB for 2zan fitted to 2zam, I find the 6 
mates arrange like 2zam, rather like 2zan (viewed by Chimera).
 
Thus, will you please explain which remark information decide the mate 
arrangement, as in the  remark added PDB for 2zan fitted to 2zam? Why after 
pymol alignment, the same remark information leads to different mates 
arrangement?


I am looking forward to getting a reply from you.


Smith







-------- Forwarding messages --------
From: "Smith Liu" <smith_liu...@163.com>
Date: 2017-02-02 12:06:16
To: pymol-users@lists.sourceforge.net
Subject: symmetry and pdb remark

Dear All,



I have a symmetry problem, which I hope I can get your help.



For both PDB 2zan and 2zam, they are for the same protein, they conformation 
were similar except that 2zam was apo and 2zam was ATP binding. 2zaz was got by 
soaking the 2zam crystal with ATP. Both were P65 space group


However by getting the mates of 2zam and 2zan, you will find their 6 mates 
arrange differently ( viewed by Chimera). Can you explain to me why  their 6 
mates arrange differently?


What is more, by pymol I align 2zan onto 2zam, and I get the PDB for 2zan 
fitted to 2zam (no any remark information left after pymol saving). Then I add 
all the remark information from 2zan to the PDB for 2zan fitted to 2zam, and 
then I view the mates for the remark added PDB for 2zan fitted to 2zam, I find 
the 6 mates arrange like 2zam, rather like 2zan (viewed by Chimera).


Thus, will you please explain which remark information decide the mate 
arrangement, as in the  remark added PDB for 2zan fitted to 2zam? Why after 
pymol alignment, the same remark information leads to different mates 
arrangement?


I am looking forward to getting a reply from you.


Smith
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