Re: [ccp4bb] Ligand superposition!

2023-07-15 Thread Debanu Das
Fax: 972-8-647-2992 or 972-8-646-1710* > > > > > > > -- > *From:* CCP4 bulletin board on behalf of Subramanian, Ramaswamy > *Sent:* Friday, July 14, 2023 10:49 PM > *To:* CCP4BB@JISCMAIL.AC.UK > *Subject:* [ccp4bb] Ligand su

Re: [ccp4bb] Ligand superposition!

2023-07-15 Thread Boaz Shaanan
_ From: CCP4 bulletin board on behalf of Subramanian, Ramaswamy Sent: Friday, July 14, 2023 10:49 PM To: CCP4BB@JISCMAIL.AC.UK Subject: [ccp4bb] Ligand superposition! Hi All, I have over 50 pdb files that I have downloaded from PDB that all have the same ligand bound. I wamt to superpose the l

Re: [ccp4bb] Ligand superposition!

2023-07-15 Thread Oganesyan, Vaheh
Of Subramanian, Ramaswamy Sent: Saturday, July 15, 2023 8:10 AM To: CCP4BB@JISCMAIL.AC.UK Subject: Re: [ccp4bb] Ligand superposition! Thanks Boaz, The proteins are all completely different in folds and structures! Rams subra...@purdue.edu<mailto:subra...@purdue.edu> On Jul 15, 2023, a

Re: [ccp4bb] Ligand superposition!

2023-07-15 Thread Subramanian, Ramaswamy
> > > > From: CCP4 bulletin board on behalf of Subramanian, Ramaswamy > Sent: Friday, July 14, 2023 10:49 PM > To: CCP4BB@JISCMAIL.AC.UK > Subject: [ccp4bb] Ligand superposition! > > Hi All, > > I have over 50 pdb files that I have downloa

Re: [ccp4bb] Ligand superposition!

2023-07-15 Thread Boaz Shaanan
, 2023 10:49 PM To: CCP4BB@JISCMAIL.AC.UK Subject: [ccp4bb] Ligand superposition! Hi All, I have over 50 pdb files that I have downloaded from PDB that all have the same ligand bound. I wamt to superpose the ligands (and move the protein coordinates using that matrix). The goal is for me to see how

Re: [ccp4bb] Ligand superposition!

2023-07-15 Thread Paul Emsley
On 15/07/2023 03:49, Subramanian, Ramaswamy wrote: I have over 50 pdb files that I have downloaded from PDB that all have the same ligand bound. I wamt to superpose the ligands (and move the protein coordinates using that matrix).  The goal is for me to see how difference in ligand

[ccp4bb] Ligand superposition!

2023-07-14 Thread Subramanian, Ramaswamy
Hi All, I have over 50 pdb files that I have downloaded from PDB that all have the same ligand bound. I wamt to superpose the ligands (and move the protein coordinates using that matrix). The goal is for me to see how difference in ligand environments in different complexes. Is there an