Skip to main content

Table 4 Conserved ACE residues important for inhibitor interactions

From: Interpretable correlation descriptors for quantitative structure-activity relationships

Functional interaction C-domain residue N-domain residue
Zinc-binding 383His 361His
Zinc-binding 387His 365His
Zinc-binding 411Glu 389Glu
Inhibitor carbonyl hydrogen bonding 513His 491His
Inhibitor carbonyl hydrogen bonding 353His 331His
Inhibitor carboxy terminal carboxylic ionic bonding 511Lys 489Lys
Inhibitor carboxy terminal carboxylic hydrogen bonding 281Gln 259Gln
Inhibitor carboxy terminal carboxylic hydrogen bonding 520Tyr 498Tyr
  1. (Table formulated using information from [29, 30, 32])