X-Git-Url: http://source.jalview.org/gitweb/?a=blobdiff_plain;f=help%2Fhtml%2Ffeatures%2Fstructurechooser.html;h=04612094d9637878f8a9bd9dacafd3e5274968d1;hb=3ab582bfeeab1563bedf60e97994e63e672d2e31;hp=d9582ec72f042f415283ee7d6c2da0b05e636165;hpb=db93a1adcbe0a4eaaf06e0a70ade0d6c5c1961c3;p=jalview.git diff --git a/help/html/features/structurechooser.html b/help/html/features/structurechooser.html index d9582ec..0461209 100644 --- a/help/html/features/structurechooser.html +++ b/help/html/features/structurechooser.html @@ -31,7 +31,7 @@
The Structure Chooser interface allows you to interactively select
which PDB structures to view for the currently selected set of
- sequences. It's opened by selecting the "3D
+ sequences. It is opened by selecting the "3D
Structure Data.." option from the Sequence ID panel's pop-up menu. The dialog
provides:
@@ -46,33 +46,47 @@
+ Selecting and Viewing Structures
+
+ Once one or more structures have been selected, pressing the View
+ button will import them into a new or existing
+ structure view.
+
Automated discovery of structure data
After selecting "3D Structure Data ..", Jalview queries the PDB
- via the PDBe SOLR Rest API provided by EMBL-EBI to discover PDB ids
+
+ After selecting "3D Structure Data ..", Jalview queries the PDB via
+ the PDBe SOLR Rest API provided by EMBL-EBI to discover PDB IDs
associated with the sequence. It does this based on the sequence's
- ID string, and any other associated database IDs.
- Exploration of meta-data for available structures
+ Viewing existing
+ structures for your sequences
+
+ If you have already loaded 3D structure data for the selected
+ sequences, the structure chooser will first open with the Cached
+ Structures View. This view shows associations between each
+ sequence, and chains for 3D structure files already in memory. If
+ you want to download additional structures, select one of the other
+ options from the drop down menu.
Information on each structure available is displayed in columns
- in the dialog box. By default, only the title, resolution and PDB
- identifier are shown, but many more are provided by the PDBe. To
- configure which ones are displayed, select the 'Configure Displayed
- Columns' tab and tick the columns which you want to see.
Selection of the best structure for each sequence
Jalview can automatically select the best structures according
- to meta-data provided by the PDB. By default, the 'Best Quality'
- structure for each sequence will be selected, but clicking on the
- drop down menu allows other criteria to be chosen, including
- Resolution (only defined for X-Ray structures), Highest Protein
- Chain etc. When 'Invert' is selected, structures are selected in
- reverse order for the current criteria (e.g. worst quality rather
- than best).
+
@@ -83,13 +97,20 @@
-->
The screenshot above shows the Structure Chooser interface
along with the meta-data of auto-discovered structures for the
- sample alignment. Note however that if no structures were
- auto-discovered, a different interface for manual association will
- be invoked as seen in the screenshot below.
+ sample alignment. If no structures were
+ auto-discovered, options for manually associating PDB records will be shown (see below).
+
+ Exploration of meta-data for available structures +
+Information on each structure available is displayed in columns + in the dialog box. By default, only the title, resolution and PDB + identifier are shown, but many more are provided by the PDBe. To + configure which ones are displayed, select the 'Configure Displayed + Columns' tab and tick the columns which you want to see.
-
+
Manual selection/association of PDB files with
Sequences
- Viewing existing structures for your sequences -
-- If you have previously associated structure data on the alignment, - selecting Cached PDB Entries from the drop down - menu allows you to select these structures for display. -
The Structure Chooser interface was introduced in Jalview