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. 2021 Dec 1;11:23197. doi: 10.1038/s41598-021-02323-x

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© The Author(s) 2021

Open AccessThis article is licensed under a Creative Commons Attribution 4.0 International License, which permits use, sharing, adaptation, distribution and reproduction in any medium or format, as long as you give appropriate credit to the original author(s) and the source, provide a link to the Creative Commons licence, and indicate if changes were made. The images or other third party material in this article are included in the article's Creative Commons licence, unless indicated otherwise in a credit line to the material. If material is not included in the article's Creative Commons licence and your intended use is not permitted by statutory regulation or exceeds the permitted use, you will need to obtain permission directly from the copyright holder. To view a copy of this licence, visit http://creativecommons.org/licenses/by/4.0/.

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(a) Mean and standard deviation of the antibody radii of gyration in the apo forms (left) and holo forms (right), averaged within each conformational cluster. In the holo case, the radius is computed for the antibody alone. The error bars correspond to the standard deviation within each cluster. The shaded areas correspond to the range of variability, which is greatly reduced in the holo case. (b) Representative structures of pembrolizumab in the apo (A) and holo (H) forms, for each conformational cluster. Chains AB are in blue, chains CD in red, and the antigen PD-1 in green.