Re: [ccp4bb] [EXTERNAL] Re: [ccp4bb] Modeling ATP/ADP

2020-07-24 Thread Oleg Kovalevskiy - UKRI STFC
Dear Reza, We had a case when two phosphate ions and magnesium ion have been bound to the ATP-binding site (300mM sodium phosphate in the crystallisations conditions). However, your ATP/ADP may not have full occupancy and therefore electron density might be lower. You may consider calculation

Re: [ccp4bb] CCP4 update manager command line options?

2019-12-14 Thread Oleg Kovalevskiy - UKRI STFC
Dear Christoph, Unfortunately there is no command line option to install any earlier version; Windows installer provides only latest CCP4 version. All the best, Oleg Kovalevskiy and Andrey Lebedev -- Dr Oleg Kovalevskiy CCP4 team Science and Technology Facilities Council Rutherford Appleton