Re: [ccp4bb] Domain Motion Analysis

2020-07-09 Thread Guenter Fritz
Dear Antony, similar to the approach Eleanor has described, lsqman will give you rotational matrix and translation vector. http://xray.bmc.uu.se/usf/lsqman_man.html Best regards, Guenter Hi, You can try elNemo server. Regards, Nasrin PhD scholar On Wed, Jul 8, 2020, 10:16 PM Antony

Re: [ccp4bb] Domain Motion Analysis

2020-07-08 Thread 00000c2488af9525-dmarc-request
Hello Tony, I think CueMol gives you the screw rotation and translation when you fit domains. Jon CooperOn 8 Jul 2020 18:53, Eleanor Dodson <176a9d5ebad7-dmarc-requ...@jiscmail.ac.uk> wrote:Well - I use standard software.Use GESANT or some such program to fit Structure 2 A to Structure ! A

Re: [ccp4bb] Domain Motion Analysis

2020-07-08 Thread Eleanor Dodson
Well - I use standard software. Use GESANT or some such program to fit Structure 2 A to Structure ! A only - output wilh have all A B C but only A has been fitted// Now fit Structure 2 B from fitted structure to Structur 1 B . It will give you a PHI CHI Kappa needed to rotate B2 to B1 Is that