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Table 2 XSCORE, DrugScore and LigScore evaluation upon binary complex formation

From: Role of Serine140 in the mode of action of Mycobacterium tuberculosis β-ketoacyl-ACP Reductase (MabA)

 

XSCOREa

DrugScore

LigScore

MabAWT

7.15

-139

-14,57

MabAS140A

7.06

-136

-12,18

MabAS140T

6.10

-119

-9,30

  1. a Given in units of pKd.
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BMC Research Notes

ISSN: 1756-0500

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