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Fig. 5 | BMC Chemistry

Fig. 5

From: Leveraging structural and 2D-QSAR to investigate the role of functional group substitutions, conserved surface residues and desolvation in triggering the small molecule-induced dimerization of hPD-L1

Fig. 5

The analyses of key hydrogen bond (H-bond) interactions in the small molecule-bound and unbound systems. The frequency of H-bond distances staying within or over a 3.5 Å threshold in different residue-residue pairs such as ARG113A/GLU58B (a), ASP61A/ARG113B (b), ARG126A/GLU58B (c), ASP61A/TYR123B (d), SER117A/GLY119B (e), and TYR56A/ALA121B (f) are provided. Single letter codes of amino acids are used in the figure

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BMC Chemistry

ISSN: 2661-801X

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