Automated crystallographic ligand building using the medial axis transform of an electron-density isosurface

Aishima, J.; Russel, D.S.; Guibas, L.J.; Adams, P.D.; Brunger, A.T.

doi:10.1107/S0907444905023152

Acta Crystallographica Section D
Acta Crystallographica
Section D BIOLOGICAL CRYSTALLOGRAPHY

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Figure 6
Comparison of built models for structures containing one ligand. R.m.s.d._any is used to evaluate the ARP/wARP model closest to the deposited structure and the best model obtained by the medial axis method. An asterisk indicates ligands that were not built to within 7 Å r.m.s.d._any.

BIOLOGICAL
CRYSTALLOGRAPHY

ISSN: 1399-0047

Volume 61| Part 10| September 2005| Pages 1354-1363

doi:10.1107/S0907444905023152

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