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. 2021 Apr 8;13:673205. doi: 10.3389/fnagi.2021.673205

TABLE 2.

Docking energies for NMBSA into Kelch adaptor proteins.

Kelch domain pdb ID Protein - CDocker energy (kcal⋅mol–1) - CDocker interaction energy (kcal⋅mol–1)
4IQK Keap1 adaptor protein 14.28 46.64
3II7 KLHL7 adaptor protein (Canning et al., 2013) 16.26 50.20
6DO5 KLHDC2 adaptor protein (Rusnac et al., 2018) 12.15 46.73
4ASC KBTB5 adaptor protein (Canning et al., 2013) 6.50 43.80
5NKP KLHL3 5.63 43.97
6GY5 KLHL20 adaptor protein (Chen et al., 2019) 8.56 40.13