{% import 'xia2_macros.html' as xia2_macros %} {% extends "report_base.html" %} {% block content %}

Merging statistics

Space group: {{ space_group }}
{% if alternative_space_groups %} Alternative space groups: {% for item in alternative_space_groups %} {{ item }} {% endfor %}
{% endif %} Unit cell: {{ unit_cell }}

{{ xia2_macros.xtriage_modal("xia2.txt", xia2_output, "xia2_output")}}

{{ macros.table(overall_stats_table, has_column_header=true, has_row_header=true) }}
{% for citation, curl in references.items() %} {{citation}}
{% endfor %}

xia2 output files

  • Mtz files (useful for CCP4 and Phenix)
    {{ macros.table(mtz_files, has_column_header=true, has_row_header=false) }}
  • SCA files (useful for autoSHARP, etc.)
    {{ macros.table(sca_files, has_column_header=true, has_row_header=false) }}
  • SCA unmerged files (useful for XPREP and SHELXC/D/E)
    {{ macros.table(unmerged_sca_files, has_column_header=true, has_row_header=false) }}
  • Other files
    {{ macros.table(other_files, has_column_header=true, has_row_header=false) }}
{{ macros.table(log_files_table, has_column_header=false, has_row_header=false) }}
{% for wname, item in individual_dataset_reports.items() %}

Detailed statistics for dataset {{ wname }}

{{ macros.table(item['overall_statistics_table'], has_column_header=true, has_row_header=true) }}
{{ macros.table(item['merging_statistics_table'], has_column_header=true) }} *significant at p={{ cc_half_significance_level }}
{{ xia2_macros.xtriage_results( item['xtriage']['success'], item['xtriage']['warnings'], item['xtriage']['danger'], suffix="_"+wname) }}

Analysis plots

{{ macros.panel('Analysis by resolution', 'resolution_' + wname, item['resolution_graphs']) }} {{ macros.panel('Analysis by batch', 'batch_' + wname, item['batch_graphs']) }} {{ macros.panel('Miscellaneous', 'misc_' + wname, item['misc_graphs'], styles=styles) }}
{% endfor %}
{% endblock %}