Skip to main content

Table 2 Energetic assessment of the initial and final ERG11 Candida albicans model

From: Structural basis for heterogeneous phenotype of ERG11 dependent Azole resistance in C.albicans clinical isolates

Proteins Energy parameters
Bonds energy (KJ/mole) Angels energy (KJ/mole) Torsion energy (KJ/mole) Improper energy (KJ/mole) Nonbonded energy (KJ/mole) Electrostatic energy (KJ/mole) Toal energy (KJ/mole)
Intitial Model Wild ERG11 633.755 3071.161 2037.510 523.60 -12946.40 -13659.73 -20340.652
Final Model Wild ERG11 439.711 3200.458 2128.688 657.486 -16825.04 -14511.09 -24909.789
Template 4k0f.pdb 1105.138 2512.448 2736.639 467.556 -14620.22 -13716.33 -21514.770