Re: [ccp4bb] Anomalous substructure solution at data with 37% completeness

2011-05-04 Thread George M. Sheldrick
I think that two issues are being confused here. When the anomalous signal is very weak, e.g. for sulfur-SAD phasing, the anomalous differences are comparable with the intensity esds. By averaging over many measurements we can reduce these esds and so improve the signal to noise ratio and the ch

Re: [ccp4bb] Anomalous substructure solution at data with 37% completeness

2011-05-04 Thread Mark J van Raaij
[switch not too serious mode on]: well, it is lysozyme, which, according to diffraction properties, should perhaps be classified as a salt (LyCl7), not a protein... :-) Mark J van Raaij Laboratorio M-4 Dpto de Estructura de Macromoleculas Centro Nacional de Biotecnologia - CSIC c/Darwin 3, Campu

[ccp4bb] Anomalous substructure solution at data with 37% completeness

2011-05-04 Thread Dhanasekaran Varudharasu
Dear all, We have solved the sturcture of hen egg white lysozyme with a barium ion at 2.7 fold data redundancy. Data collected at in-house copper K-alpha source to 2.22 A resolution with 1 degree oscillation step per frame. The substructure was correctly identified with just 8