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Table 3 Distance between Ubiquinone and Heme interacting

From: Revealing the functionality of hypothetical protein KPN00728 from Klebsiella pneumonia e MGH78578: molecular dynamics simulation approaches

Interaction

MD result (Ã…)

Docking result (Ã…)

TYR83@OH and UQ@O1

2.68 ± 0.49

2.58

ARG31@NH1 and UQ@O2

4.40 ± 1.26

3.83

SER27@OG and UQ@O3

8.83 ± 2.84

2.68

HIS84@ND and HEME@FE

7.07 ± 0.43

3.25

HIS71@ND and HEME@FE

6.43 ± 0.79

1.29

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BMC Bioinformatics

ISSN: 1471-2105

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