Table 15: Ferulic acid interaction. | ||||
Polar |
Hydrophobic |
pi-pi |
Cation-pi |
Other |
O4 (4) TRP94 |
C10 (14) TRP94 |
C1 (5) TRP94 |
H1 (15) HIS113 |
O4 (4) PHE93 |
– |
– |
– |
– |
– |
[3.75] (NE1) |
[3.58] (CD1, CG) |
[3.68] (CH2, CZ2) |
[3.62] (CD2) |
[3.23] (CB) |
O3 (3) ASP97 |
C8 (12) TRP94 |
C4 (8) TRP94 |
H1 (15) TYR116 |
O4 (4) TRP94 |
– |
– |
– |
– |
– |
[3.37] (OD1) |
[3.59] (CD1,CE2) |
[3.51] (CZ2) |
[3.72] (CD2,CE2) |
[3.29] (CD1, CG) |
O1 (1) HIS113 |
C7 (11) TRP94 |
C5 (9) HIS113 |
|
C8 (12) TRP94 |
– |
– |
– |
– |
|
[3.74] (NE2) |
[3.74] (CE2,CZ2) |
[3.05] (CD2,CG) |
[3.50] (NE1) |
|
O2 (2) ARG188 |
C10 (14) TRP102 |
C6 (10) HIS113 |
|
C10 (14) TRP94 |
– |
– |
– |
– |
|
[3.59] (CZ, NH1,NH2) |
[3.57] (CZ3) |
[3.27] (CD2,CG) |
[3.83] (NE1) |
|
H1 (15) ARG188 |
C8 (12) VAL112 |
C2 (6) HIS113 |
|
O3 (3) ASP97 |
– |
– |
– |
– |
|
[2.99] (CZ, NH1,NH2) |
[3.31] (CG2) |
[3.51] (CD2) |
[3.53] (CB, CG) |
|
O1 (1) ARG188 |
C10 (14) VAL112 |
C4 (8) HIS113 |
|
O3 (3) TRP102 |
– |
– |
– |
– |
|
[3.18] (NH1) |
[3.77] (CG2) |
[3.88] (CD2) |
[3.62] (CZ3) |
|
|
|
C1 (5) HIS113 |
|
O4 (4) TRP102 |
– |
– |
|||
[3.89] (CE1) |
[3.34] (CH2,CZ3) |
|||
|
|
C6 (10) TYR116 |
|
O4 (4) VAL112 |
– |
– |
|||
[3.32] (CB, CD2,CG) |
[3.52] (CB, CG2) |
|||
|
|
C5 (9) TYR116 |
|
O2 (2) HIS113 |
– |
– |
|||
[3.60] (CD2) |
[3.26] (CD2) |
|||
|
|
|
|
C1 (5) HIS113 |
– |
||||
[3.86] (NE2) |
||||
|
|
|
|
C2 (6) HIS113 |
– |
||||
[3.27] (NE2) |
||||
|
|
|
|
C3 (7) HIS113 |
– |
||||
[3.51] (NE2) |
||||
|
|
|
|
C5 (9) HIS113 |
– |
||||
[3.36] (NE2) |
||||
|
|
|
|
C6 (10) HIS113 |
– |
||||
[3.71] (NE2) |
||||
|
|
|
|
C9 (13) HIS113 |
– |
||||
[3.81] (NE2) |
||||
|
|
|
|
O2 (2) TYR116 |
|
|
|
|
C9 (13) ASP187 |
|
|
|
|
C9 (13) ARG188 |