Figure 3

NOEs for Ile3 Hβ of 1D3Z, in KiNG vs KinImmerse user session. a) Traditional display of the 10-model 1D3Z ubiquitin ensemble [42] in KiNG, with backbone in white and sidechains cyan. For model 1, the Hβ of Ile3 is highlighted with a brown ball and NOE measurements between it and neighboring atoms are shown as dotted lines. b) Working KinImmerse session in the DiVE, for those same NOEs (dashed lines). All models were co-centered on Ile3 Hβ (gray ball), but only model 1 is shown here for clarity on the flat page; bonds to H atoms are in orange for emphasis. The user has drawn a 3D annotation to indicate that the distances to the two Hβs of Ser65 appear to be reversed. Photographed in the DiVE by JNB, VBC, and DCR.