Re: [ccp4bb] Enhanced Validation of Small-Molecule Ligands and Carbohydrates

2021-03-18 Thread Cyril Hamiaux
ed (by which I mean "agreed upon") and so the distribution On 18/03/2021 07:19, Cyril Hamiaux wrote: Dear Jasmine (and all), Many thanks for the article. I have a question regarding the Z cutoffs used to flag geometry outliers in the PDB validation reports: geometry outliers are flagge

Re: [ccp4bb] Enhanced Validation of Small-Molecule Ligands and Carbohydrates

2021-03-18 Thread Cyril Hamiaux
Dear Jasmine (and all), Many thanks for the article. I have a question regarding the Z cutoffs used to flag geometry outliers in the PDB validation reports: geometry outliers are flagged with |Z|>2 for ligands (including carbohydrates), but with |Z|>5 for proteins. What is the rational for usin

[ccp4bb] Two PhD positions at the New Zealand Institute for Plant and Food Research, Auckland

2014-01-20 Thread Cyril Hamiaux
any of these projects please contact: Dr Kim Snowden (kimberley.snow...@plantandfood.co.nz<mailto:kimberley.snow...@plantandfood.co.nz>), Dr Cyril Hamiaux (cyril.hami...@plantandfood.co.nz<mailto:cyril.hami...@plantandfood.co.nz>) or Professor Richard Newcomb (richard.newc...@planta