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. 2020 May 25;23(1):59–74. doi: 10.1080/15685551.2020.1767490

Table 7.

Distance and energy between PU1, PU2, and PU3 with 5fsa receptor

Product Ligand Receptor Interaction Distance E (kcal/mol)
PU1 - - - - -
PU2 N 71 O SER 378 (A) H-donor 3.29 −2.1
PU3 S 42 O SER 378 (A) H-donor 3.68 −0.5
N 43 SD MET 508 (A) H-donor 4.07 −2.7
5-ring CD1 LEU 376 (A) pi-H 3.86 −1.0