-----BEGIN PGP SIGNED MESSAGE----- Hash: SHA1 Dear Jonathan, you can read it into xprep to generate idealised data then pretend a SAD experiment to get the _fa.hkl file. On the way there you will get a table with anomalous signal / noise ratio. Best, Tim On 04/03/2014 04:20 PM, Jonathan Grimes wrote:
Given a refined protein structure, is there an straightforward way to calculate the anomalous differences as a function of resolution, at wavelength X.
many thanks jon
Dr. Jonathan M. Grimes, NDM Senior Reseach Fellow University Research Lecturer DIAMOND Research Fellow
Division of Structural Biology Wellcome Trust Centre for Human Genetics University of Oxford Roosevelt Drive, Oxford OX3 7BN, UK
Email: [email protected], Web: www.strubi.ox.ac.uk Tel: (+44) - 1865 - 287561, FAX: (+44) - 1865 - 287547
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- -- - -- Dr Tim Gruene Institut fuer anorganische Chemie Tammannstr. 4 D-37077 Goettingen GPG Key ID = A46BEE1A -----BEGIN PGP SIGNATURE----- Version: GnuPG v1.4.12 (GNU/Linux) Comment: Using GnuPG with Icedove - http://www.enigmail.net/ iD8DBQFTPXSRUxlJ7aRr7hoRAi64AKD27XNiNqQCDNalGiYQAVBL/6nZ8gCfcnMr jLwMEvBW1zz6RNb7F9R7xuU= =5M+m -----END PGP SIGNATURE-----