Dimple

Click here to find out how to use DIMPLE.

The difference map pipeline DIMPLE takes the results of fast_dp and a directory of coordinate files provided by the user and: selects the most appropriate coordinate file based on the name, pointgroup and unit cell constants; copies across the spacegroup information and reindexes the data to match; computes structure factor amplitudes; performs rigid body refinement and optionally molecular replacement followed by restrained refinement using refmac5, to give a difference map, refined coordinates and an indication of the quality of refinement (Figure 1,2).


Figure 1 Workflow for difference map pipeline dimple

 


Figure 2 Illustration of results from dimple pipeline

 

Diamond Light Source

Diamond Light Source is the UK's national synchrotron science facility, located at the Harwell Science and Innovation Campus in Oxfordshire.

Copyright © 2022 Diamond Light Source

 

Diamond Light Source Ltd
Diamond House
Harwell Science & Innovation Campus
Didcot
Oxfordshire
OX11 0DE

See on Google Maps

Diamond Light Source® and the Diamond logo are registered trademarks of Diamond Light Source Ltd

Registered in England and Wales at Diamond House, Harwell Science and Innovation Campus, Didcot, Oxfordshire, OX11 0DE, United Kingdom. Company number: 4375679. VAT number: 287 461 957. Economic Operators Registration and Identification (EORI) number: GB287461957003.

feedback