## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
A |
67 |
20 |
4863 |
x |
A |
-y,x-y-1,z |
2_545 |
82 |
22 |
4863 |
845.1 |
-17.6 |
0.126 |
4 |
4 |
0 |
1.000 |
2 |
|
A |
38 |
12 |
4863 |
◊ |
A |
-x,-x+y,-z+1 |
6_556 |
38 |
12 |
4863 |
346.0 |
4.6 |
0.948 |
6 |
4 |
0 |
0.000 |
3 |
|
H |
38 |
8 |
1583 |
◊ |
A |
x,y,z |
1_555 |
29 |
7 |
4863 |
295.4 |
-7.2 |
0.295 |
0 |
0 |
0 |
0.942 |
4 |
|
A |
23 |
6 |
4863 |
◊ |
H |
-y,x-y-1,z |
2_545 |
27 |
5 |
1583 |
230.3 |
-4.3 |
0.458 |
2 |
0 |
0 |
0.174 |
5 |
|
[CXS]H:18 |
13 |
1 |
398 |
◊ |
H |
x,y,z |
1_555 |
19 |
7 |
1583 |
134.2 |
3.0 |
0.018 |
3 |
0 |
0 |
0.000 |
6 |
|
H |
12 |
5 |
1583 |
◊ |
A |
-x,-x+y,-z+1 |
6_556 |
10 |
3 |
4863 |
94.2 |
-2.1 |
0.423 |
0 |
0 |
0 |
0.000 |
7 |
|
H |
12 |
2 |
1583 |
◊ |
A |
x-y-1,-y-1,-z |
5_445 |
9 |
3 |
4863 |
91.8 |
-1.0 |
0.632 |
0 |
0 |
0 |
0.000 |
8 |
|
[CXS]H:18 |
6 |
1 |
398 |
◊ |
A |
-x,-x+y,-z+1 |
6_556 |
12 |
3 |
4863 |
86.1 |
2.5 |
0.123 |
4 |
0 |
0 |
0.000 |
9 |
|
H |
11 |
3 |
1583 |
◊ |
A |
y,x-1,-z+1 |
4_546 |
8 |
2 |
4863 |
74.6 |
0.1 |
0.761 |
1 |
0 |
0 |
0.000 |
10 |
|
H |
8 |
3 |
1583 |
◊ |
A |
-x,-x+y,-z |
6_555 |
5 |
1 |
4863 |
70.9 |
1.0 |
0.811 |
2 |
0 |
0 |
0.000 |
11 |
|
[ACE]H:1 |
3 |
1 |
170 |
cf |
H |
x,y,z |
1_555 |
10 |
3 |
1583 |
70.8 |
-1.0 |
0.795 |
0 |
0 |
0 |
0.211 |
12 |
|
[ACE]A:0 |
3 |
1 |
171 |
cf |
A |
x,y,z |
1_555 |
7 |
4 |
4863 |
69.4 |
-0.3 |
0.802 |
2 |
0 |
0 |
0.160 |
13 |
|
H |
6 |
2 |
1583 |
x |
H |
-y-1,x-y-1,z |
2_445 |
7 |
2 |
1583 |
54.8 |
-0.0 |
0.727 |
0 |
0 |
0 |
0.000 |
14 |
|
[NH2]A:46 |
1 |
1 |
117 |
cf |
A |
x,y,z |
1_555 |
7 |
4 |
4863 |
54.7 |
0.8 |
0.807 |
0 |
0 |
0 |
0.000 |
15 |
|
[CXS]H:18 |
7 |
1 |
398 |
◊ |
H |
-y-1,x-y-1,z |
2_445 |
9 |
3 |
1583 |
53.7 |
1.8 |
0.050 |
0 |
0 |
0 |
0.000 |
16 |
|
[ACE]H:1 |
3 |
1 |
170 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
4863 |
51.9 |
-0.2 |
0.797 |
1 |
0 |
0 |
0.078 |
17 |
|
[NH2]H:17 |
1 |
1 |
117 |
cf |
H |
x,y,z |
1_555 |
6 |
4 |
1583 |
45.3 |
0.5 |
0.841 |
0 |
0 |
0 |
0.000 |
18 |
|
[CXS]H:18 |
5 |
1 |
398 |
x |
[CXS]H:18 |
-y-1,x-y-1,z |
2_445 |
5 |
1 |
398 |
37.6 |
2.5 |
0.015 |
0 |
0 |
0 |
0.000 |
19 |
|
[ACE]A:0 |
1 |
1 |
171 |
◊ |
H |
-x,-x+y,-z+1 |
6_556 |
8 |
2 |
1583 |
34.7 |
-1.1 |
0.641 |
0 |
0 |
0 |
0.000 |
20 |
|
[CXS]H:18 |
4 |
1 |
398 |
◊ |
[ACE]A:0 |
-x,-x+y,-z+1 |
6_556 |
2 |
1 |
171 |
33.9 |
-0.3 |
0.032 |
0 |
0 |
0 |
0.019 |
21 |
|
H |
7 |
2 |
1583 |
◊ |
[NH2]A:46 |
x-y-1,-y-1,-z |
5_445 |
1 |
1 |
117 |
31.6 |
-0.1 |
0.778 |
0 |
0 |
0 |
0.000 |
22 |
|
[NH2]H:17 |
1 |
1 |
117 |
◊ |
A |
-x,-x+y,-z+1 |
6_556 |
5 |
2 |
4863 |
30.1 |
-0.0 |
0.740 |
0 |
0 |
0 |
0.000 |
23 |
|
A |
2 |
1 |
4863 |
◊ |
A |
y+1,x-1,-z |
4_645 |
3 |
1 |
4863 |
25.7 |
-0.8 |
0.368 |
0 |
0 |
0 |
0.000 |
24 |
|
[CXS]H:18 |
5 |
1 |
398 |
f |
A |
y,x-1,-z+1 |
4_546 |
3 |
1 |
4863 |
23.4 |
1.2 |
0.045 |
0 |
0 |
0 |
0.000 |
25 |
|
[NH2]H:17 |
1 |
1 |
117 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
4863 |
22.9 |
-0.1 |
0.658 |
0 |
0 |
0 |
0.019 |
26 |
|
[NH2]A:46 |
1 |
1 |
117 |
◊ |
A |
-y,x-y-1,z |
2_545 |
1 |
1 |
4863 |
1.1 |
0.1 |
0.901 |
0 |
0 |
0 |
0.000 |
|