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chiLife: An open-source Python package for in silico spin labeling and integrative protein modeling

Fig 4

Three spin labels added to chiLife and attached to T4 lysozyme (PDBID: 2LZM) at site 109.

R3 (left, sticks with blue carbons) is a small highly mobile nitroxide label. Gd(III)-DO3A (center, sticks with dark red carbons) is a gadolinium-based spin label resistant to reduction. NOBA (right, sticks with green carbons) is a biorthogonal nitroxide. The surface is made by pseudo-atoms at the rotamer spin centers.

Fig 4

doi: https://doi.org/10.1371/journal.pcbi.1010834.g004