[ccp4bb] modified amino acid

2015-05-29 Thread Bio Physics
Hi all, I have a modified amino acid (covalent complex), during refmac5 refinement it isolated from next residues. Phenix does well though with the same .cif file. I know people are doing this every day in refmac. Any help please?

[ccp4bb] Data reduction

2015-05-27 Thread Bio Physics
Hi All, Scalepack output says 98.8% complete data but after converted to .mtz file it reduced to 64%. I have tried in CCP4 and phenix both. How is it possible? Ayan

Re: [ccp4bb] CYS mod

2015-05-13 Thread Bio Physics
ers, > Aaron > -- > Dr. Aaron Finke > Postdoctoral Fellow > Swiss Light Source > WSLA/217 > CH-5232 Villigen-PSI > phone: +41 56 310 5652 > e-mail: aaron.fi...@psi.ch > > On May 13, 2015, at 0:15, Bio Physics wrote: > >

Re: [ccp4bb] CYS mod

2015-05-13 Thread Bio Physics
e Estructura de Macromoleculas > Centro Nacional de Biotecnologia - CSIC > c/Darwin 3 > E-28049 Madrid, Spain > tel. (+34) 91 585 4616 > http://www.cnb.csic.es/~mjvanraaij > > > > > > > > > On 13 May 2015, at 00:15, Bio Physics wrote: > > > No, i

Re: [ccp4bb] CYS mod

2015-05-12 Thread Bio Physics
Dept. of >> Life Sciences Ben-Gurion University of >> the Negev Beer-Sheva >> 84105 >> Israel >> E-mail: >> bshaa...@bgu.ac.il Phone: 972-8-647-2220 Skype: >> boaz.shaa

[ccp4bb] Active site Volume

2015-01-09 Thread Bio Physics
Hello CCP4bb: Help me to advice any program/server to calculate active site volume without substrate/inhibitor and volume of the substrate/inhibitor itself. Q-site-finder website is not working. Thank you, Ayan

Re: [ccp4bb] Postdoctoral Fellow Position – Structural Biology at Rutgers University School of Dental Medicine

2015-01-09 Thread Bio Physics
Hello CCP4bb: Help me to advice any program/server to calculate active site volume without substrate/inhibitor and volume of the substrate/inhibitor itself. Q-site-finder website is not working. Thank you, Ayan On Fri, Dec 19, 2014 at 7:51 AM, Vijay Parashar wrote: > A postdoctoral position