Skip to main content
. 2001 Sep 11;1:4. doi: 10.1186/1472-6807-1-4

Table IV (B).

Water involved in the interaction inside active site cleft of the enzyme-inhibitor complexes

Papain + E-64-C[32,33] Distances in Å Subsites of inhibitor
in interaction
E-64-C (I):O18 232:OH2 2.98** P1
E-64-C(II):O18 389:OH2 2.60** P1
Caricain + E-64-C
E-64-C:O18 1468:OH2 3.47** P1
E-64-C:O17 1520:OH2 3.46 P1
Chymopapain + E-64-C
E-64-C:O18 1464:OH2 2.69** P1
E-64-C:O9 1317:OH2 3.20 P2
Actinidin + E-64-C
E-64-C:O18 1489:OH2 2.85** P1
E-64-C:O9 1152:OH2 3.32 P2
E-64-C:O1 1454:OH2 3.21 P1
CalotropinDI + E-64-C
E-64-C:O18 445:OH2 3.09** P1
E-64-C:O18 441:OH2 3.29** P1
E-64-C:O17 455:OH2 3.21 P1
E-64-C:O9 1299:OH2 2.84 P2
E-64-C:O5 1406:OH2 3.41 P1
1299:OH2 1406:OH2 3.16
Papain + E-64[19]
E-64:O18 217:OH2 2.67** P1
E-64:N17 216:OH2 2.45* P3
Actinidin + E-64[20]
E-64:O18 582H:OH2 2.81** P1
E-64:N17 257H:OH2 3.23* P3
E-64:N15 54H:OH2 3.01
E-64:N17 54:OH2 3.57 P3
E-64:N15 54:OH2 3.01 P3
Caricain + E-64[21]
E-64:O18 310H:O 2.98** P1
Chymopapain + E-64
E-64:O18 302:OH2 3.21** P1
E-64:O9 1357:OH2 2.85 P2
E-64:N18 1128:OH2 3.14 P3
CalotropinDI + E-64
E-64:O18 196:OH2 2.91** P1
E-64:O17 196:OH2 3.39 P1
E-64:O9 1370:OH2 2.94 P2
E-64:N15 1310:OH2 3.43* P3
E-64:N18 1625:OH2 3.25 P3
E-64:N18 1363:OH2 3.06 P3
E-64:N17 1310:OH2 3.22* P3