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. Author manuscript; available in PMC: 2010 Dec 1.
Published in final edited form as: J Chem Inf Model. 2009 Dec;49(12):2726–2734. doi: 10.1021/ci900186w

Table 1.

Two matrix metalloproteinase inhibitors (MMPIs) found to be biologically active against the anthrax toxin lethal factor, with IC50 values from in vitro FRET assays reported with standard errors of measurement, and total Surflex-Dock scores.

Compound IC50 (µM) Total Surflex-Dock
Score (−log Kd)
graphic file with name nihms161077t1.jpg 10.2 ± 0.72 10.55
graphic file with name nihms161077t2.jpg 7.1 ± 1.28 12.31