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Table 7 Docking results of tentatively identified compounds (L1-L9) against receptor 4TR6

From: Insights into metabolic and pharmacological profiling of Aspergillus ficuum through bioinformatics and experimental techniques

Receptors

Ligands

Number of interactions

Binding energy (Kcalmol-1)

Interacting residues

4TR6

L1

L2

L3

L4

L5

L6

L7

L8

L9

02

01

02

05

03

04

05

03

03

-6.2235

-5.7973

-7.3578

-5.5456

-8.6359

-9.9476

-8.4604

-8.2522

-7.0680

LYS190, GLN260

ASP18

LEU217, ASP218

ILE216, ASP18, LYS238, ASP218, ASP18

LYS 238, LYS 238, LEU223

ILE216, LYS238, GLN17, LYS238

2ASP18, LYS21, LEU217, ASP218

LEU217, LYS21, ASP218

ILE216, LYS238, ILE216