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servalcat - Cryo-EM SPA Reciprocal-Space Refinement Tool

Performs reciprocal-space refinement and map calculation for cryo-EM SPA and crystallography

Tags

Updated: 2026-05-09

Capabilities

Typical Inputs

Typical Outputs

What this skill does

  • refine models against half-maps
  • calculate Fo-Fc maps
  • calculate omit maps
  • trim map files
  • expand NCS symmetry
  • find map peaks
  • convert FSC JSON to CSV
  • refine crystallographic models

Inputs

  • PDB model file
  • mmCIF model file
  • half-map files
  • resolution value
  • mask file
  • ligand restraint dictionary
  • point group symmetry
  • helical symmetry parameters
  • keyword restraint file

Outputs

  • refined PDB model
  • refined mmCIF model
  • symmetry-expanded model
  • Fo-Fc map files
  • normalized Fo-Fc map
  • FSC curve log
  • Coot script

Requirements

  • unsharpened half-maps
  • Python environment
  • pip or CCP4 v9.0+

Source

  • Spec: SKILL.md
cryo-EM
SPA
structure refinement
map calculation
crystallography
refine models against half-maps
calculate Fo-Fc maps
calculate omit maps
trim map files
PDB model file
mmCIF model file
half-map files
refined PDB model
refined mmCIF model
symmetry-expanded model