ARCIMBOLDO


Ab Initio macromolecular phasing has been traditionally limited to small proteins at atomic resolution (1.2Å or better unless heavy atoms are present). ARCIMBOLDO constitutes a general method for 2Å data, based on combination of location of model fragments like small ?-helices with PHASER and density modification with SHELXE, distributed over a grid of computers.

Website http://chango.ibmb.csic.es/arcimboldo
Licenses Site or group licence
Categories Crystallography
Software Requirements Phaser Shelxe Python
Hardware Requirements Running on a HPC grid
Platforms Linux
Languages Python
Input Formats ASCII CCP4 HKLF
Output Formats PDB HTML PHS
How-to

setup.bor

[LOCAL]
python_local_interpreter:
path_local_phaser: /mnt/hpcsoftware/share/phenix/phenix.phaser
path_local_shelxe: /mnt/hpcsoftware/share/shelx/shelxe
path_local_borges: /mnt/hpcsoftware/share/arcimboldo/BORGES_MATRIX
path_local_arcimboldo: /mnt/hpcsoftware/share/arcimboldo/ARCIMBOLDO_BORGES
[GRID]
type_local: SLURM
type_remote: SLURM
Documentation / Tutorials

Online manual

References

Rodríguez, D.D.; Grosse, C.; Himmel, S.; González, C.; Ilarduya, I.M.; Becker, S.; Sheldrick, G.M. & Usón, I. "Crystallographic ab initio protein structure solution below atomic resolution". Nature Methods. 6(9), 651-653 (2009).

Instruments BL13-XALOC (ALBA)
No screenshots have been uploaded for this software.
This software is used at these institutes
No example datasets have been uploaded for this software.