Time-series analysis of rhenium(I) organometallic covalent binding to a model protein for drug development

Jacobs, F.J.F.; Helliwell, J.R.; Brink, A.

doi:10.1107/S2052252524002598

Figure 8
Graphical representation of the formation of the π–π cage structure between the Asp101 and Asp119 metal complex sites. Left: the week 1 data (laboratory at λ = 1.54 Å). Right: the week 38 data (DLS at λ = 0.976 Å). For both images, insets of the metal complex and their electron densities are indicated: 2F_o – F_c (blue) contoured at 1.5σ. F_o − F_c (green for positive density and red for negative). Anomalous difference density map (orange) contoured at 3.00σ. UCSF Chimera version 1.16 was used for figure generation, the insets were drawn using UCSF ChimeraX (Pettersen et al., 2021