Structural analysis of peptides that fill sites near the active center of the two different enzyme molecules by artificial intelligence and computer simulations
Using artificial intelligence, the binding styles of 167 tetrapeptides were predicted in the active site of papain and cathepsin K. Five tetrapeptides (Asn–Leu–Lys–Trp, Asp–Gln–Trp–Gly, Cys–Gln–Leu–Arg, Gln–Leu–Trp–Thr and Arg–Ser–Glu–Arg) were found to bind sites near the active center of both papa...
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| Format: | Article |
| Language: | English |
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AIP Publishing LLC
2018-05-01
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| Series: | AIP Advances |
| Online Access: | http://dx.doi.org/10.1063/1.5033471 |