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. 2018 Jan 17;7(2):244–257. doi: 10.1039/c7tx00300e

Table 2. Binding affinities of TiO2 with different protein receptors, showing H-bonding interactions.

Receptors Binding energy (kcal mol–1) Binding residues H-Bond length Atoms involved (TiO2-receptor residues)
he1a –3.39 Asn258 2.94 O1–OD1
sod1 –3.80 Val82 2.96 O2–N
Asn66 2.38 O1–OD1
Asn66 3.12 O2–OD1
apoa1a –2.44 Leu84 2.73 O1–O
Leu84 3.07 O2–O
Thr85 2.89 O1O
tp53 –3.14 Arg314 2.80 O2–N
Arg310 3.07 O2–O
Arg310 3.14 O1–O
Glu313 3.10 O1–OE1
Glu302 2.96 O1–OE1