X-Git-Url: http://source.jalview.org/gitweb/?p=jalview.git;a=blobdiff_plain;f=help%2Fhtml%2Ffeatures%2Fstructurechooser.html;h=d9582ec72f042f415283ee7d6c2da0b05e636165;hp=902bcdb248b83a57c4f004ffff4e4d204898a478;hb=db93a1adcbe0a4eaaf06e0a70ade0d6c5c1961c3;hpb=a90e2fe3cc3b779521a81cf8de410936f3a777c1 diff --git a/help/html/features/structurechooser.html b/help/html/features/structurechooser.html index 902bcdb..d9582ec 100644 --- a/help/html/features/structurechooser.html +++ b/help/html/features/structurechooser.html @@ -28,57 +28,51 @@ Structure Chooser

- The Structure Chooser interface provides a smart technique for - selecting PDB structures to view in Jalview by querying readily - available meta-data of structures. The Interface can be invoked by - selecting the - "3D Structure Data.." option from a sequence's - pop-up menu. Some of the main - features it provides are listed below: +

+ 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 + Structure Data.." option from the Sequence ID panel's pop-up menu. The dialog + provides: +

- Additionally, the Structure Chooser retains the following contemporary - features of Jalview: - - - Associating PDB files with Sequences -
Discovery/Association of PDB entries to a sequence now - happens automatically during the initialisation of the Structure - Chooser Interface. Jalview uses the sequence's ID to query the PDB - Rest API provided by the EBI to discover PDB Ids associated with the - sequence. - -
-
- Configuring displayed meta-data for Structures -
To configure the visible meta-data displayed for the - discovered structures, click the 'Configure Displayed Columns' tab, - then tick the options which you intend to make visible. - -
-
- Auto-selection of best Structures -
Jalview can automatically filter and select the best - structures using various metric categories avaialble from the - meta-data of the structures. To perform this simply select any of the - following options from the drop-down menu in the Structure Chooser - interface: Best Uniprot coverage, Higest Resolution, Best Quality, - Highest Protein Chain etc. When the 'Invert' option is selected, - Jalview returns an inverse result for the current selected option in - the drop-down menu. +

+ 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 + 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 +

+

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).

@@ -94,30 +88,30 @@ be invoked as seen in the screenshot below.

+ style="width: 464px; height: 369px;">

Manual selection/association of PDB files with Sequences

-

To manually associate PDB files with a sequence, select any of - the follwing options listed below from the drop-down menu in the - interface: +

To manually associate PDB files with a sequence, select 'From + File', or 'Enter PDB Id' from the drop-down menu:

+

+ 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