| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
| 1 |
1 |
|
[LIV]B:2001 |
39 |
1 |
940 |
f |
B |
x,y,z |
1_555 |
57 |
12 |
4767 |
455.7 |
-14.8 |
0.803 |
9 |
0 |
0 |
0.081 |
| 2 |
2 |
|
[LIV]A:1001 |
45 |
1 |
946 |
f |
A |
x,y,z |
1_555 |
54 |
11 |
4754 |
428.7 |
-15.5 |
0.799 |
6 |
0 |
0 |
0.059 |
| 3 |
3 |
|
B |
51 |
8 |
4767 |
◊ |
A |
x,y,z |
1_555 |
49 |
8 |
4754 |
372.4 |
-0.7 |
0.951 |
16 |
0 |
0 |
0.025 |
| 4 |
4 |
|
[5BU]A:3 |
21 |
1 |
442 |
cf |
A |
x,y,z |
1_555 |
32 |
5 |
4754 |
236.3 |
1.2 |
0.856 |
1 |
0 |
0 |
0.000 |
5 |
|
[5BU]B:3 |
21 |
1 |
442 |
cf |
B |
x,y,z |
1_555 |
31 |
4 |
4767 |
235.2 |
1.8 |
0.865 |
1 |
0 |
0 |
0.000 |
| Average: |
235.7 |
1.5 |
0.861 |
1 |
0 |
0 |
0.000 |
| 5 |
6 |
|
B |
26 |
6 |
4767 |
◊ |
B |
x,-y-1,-z |
4_545 |
26 |
6 |
4767 |
212.9 |
-6.0 |
0.646 |
0 |
0 |
0 |
0.013 |
| 6 |
7 |
|
B |
29 |
2 |
4767 |
◊ |
A |
x-1/2,y-1/2,z |
5_445 |
30 |
2 |
4754 |
191.6 |
4.2 |
0.972 |
0 |
0 |
0 |
0.000 |
| 7 |
8 |
|
A |
19 |
5 |
4754 |
x |
A |
x-1/2,-y-1/2,-z |
8_445 |
16 |
3 |
4754 |
140.6 |
-2.9 |
0.683 |
1 |
0 |
0 |
0.000 |
| 8 |
9 |
|
[LIV]B:2001 |
15 |
1 |
940 |
◊ |
A |
x,y,z |
1_555 |
14 |
3 |
4754 |
122.4 |
-7.2 |
0.477 |
3 |
0 |
0 |
0.028 |
| 9 |
10 |
|
[LIV]A:1001 |
15 |
1 |
946 |
◊ |
B |
x,y,z |
1_555 |
13 |
3 |
4767 |
117.6 |
-7.4 |
0.445 |
2 |
0 |
0 |
0.027 |
| 10 |
11 |
|
[K]A:1002 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
4754 |
103.5 |
-64.2 |
0.000 |
0 |
0 |
0 |
0.415 |
12 |
|
[K]B:2002 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
16 |
8 |
4767 |
103.3 |
-63.9 |
0.000 |
0 |
0 |
0 |
0.415 |
| Average: |
103.4 |
-64.0 |
0.000 |
0 |
0 |
0 |
0.415 |
| 11 |
13 |
|
A |
13 |
2 |
4754 |
◊ |
A |
-x+1,y,-z+1/2 |
3_655 |
13 |
2 |
4754 |
101.3 |
1.2 |
0.859 |
2 |
0 |
0 |
0.000 |
| 12 |
14 |
|
B |
12 |
1 |
4767 |
◊ |
A |
-x+1,y,-z+1/2 |
3_655 |
13 |
2 |
4754 |
94.3 |
2.0 |
0.870 |
2 |
0 |
0 |
0.000 |
| 13 |
15 |
|
B |
14 |
2 |
4767 |
◊ |
B |
-x,y,-z+1/2 |
3_555 |
14 |
2 |
4767 |
90.7 |
3.2 |
0.939 |
0 |
0 |
0 |
0.000 |
| 14 |
16 |
|
[K]A:44 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
13 |
4 |
4754 |
90.0 |
-55.0 |
0.000 |
0 |
0 |
0 |
0.178 |
| 15 |
17 |
|
[K]B:90 |
1 |
1 |
216 |
x |
B |
x,y,z |
1_555 |
9 |
4 |
4767 |
64.8 |
-33.2 |
0.000 |
0 |
0 |
0 |
0.284 |
| 16 |
18 |
|
B |
13 |
3 |
4767 |
◊ |
A |
x-1/2,-y-1/2,-z |
8_445 |
11 |
3 |
4754 |
63.4 |
-3.1 |
0.557 |
0 |
0 |
0 |
0.007 |
| 17 |
19 |
|
[K]B:2002 |
1 |
1 |
216 |
f |
[5BU]B:3 |
x,y,z |
1_555 |
5 |
1 |
442 |
61.5 |
-32.1 |
0.000 |
0 |
0 |
0 |
0.201 |
20 |
|
[K]A:1002 |
1 |
1 |
216 |
f |
[5BU]A:3 |
x,y,z |
1_555 |
5 |
1 |
442 |
58.1 |
-29.9 |
0.000 |
0 |
0 |
0 |
0.201 |
| Average: |
59.8 |
-31.0 |
0.000 |
0 |
0 |
0 |
0.201 |
| 18 |
21 |
|
A |
9 |
2 |
4754 |
◊ |
[5BU]A:3 |
x-1/2,-y-1/2,-z |
8_445 |
7 |
1 |
442 |
60.5 |
-1.7 |
0.503 |
0 |
0 |
0 |
0.000 |
| 19 |
22 |
|
B |
5 |
1 |
4767 |
◊ |
[K]A:44 |
x-1/2,y-1/2,z |
5_445 |
1 |
1 |
216 |
52.0 |
-25.3 |
0.000 |
0 |
0 |
0 |
0.077 |
| 20 |
23 |
|
[K]B:90 |
1 |
1 |
216 |
x |
[5BU]B:3 |
x,y,z |
1_555 |
4 |
1 |
442 |
47.1 |
-22.8 |
0.000 |
0 |
0 |
0 |
0.195 |
| 21 |
24 |
|
[CL]B:66 |
1 |
1 |
125 |
◊ |
[K]A:44 |
x-1/2,y-1/2,z |
5_445 |
1 |
1 |
216 |
45.2 |
-23.6 |
0.000 |
0 |
0 |
0 |
0.071 |
| 22 |
25 |
|
[CL]B:66 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
4 |
3 |
4767 |
37.1 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.015 |
| 23 |
26 |
|
B |
2 |
1 |
4767 |
◊ |
A |
x-3/2,y-1/2,z |
5_345 |
4 |
2 |
4754 |
21.7 |
-1.4 |
0.401 |
0 |
0 |
0 |
0.000 |
| 24 |
27 |
|
B |
3 |
2 |
4767 |
◊ |
A |
x-1,y,z |
1_455 |
3 |
2 |
4754 |
21.6 |
-1.8 |
0.383 |
0 |
0 |
0 |
0.000 |
| 25 |
28 |
|
[LIV]B:2001 |
3 |
1 |
940 |
◊ |
[LIV]A:1001 |
x,y,z |
1_555 |
1 |
1 |
946 |
19.7 |
-0.0 |
0.797 |
0 |
0 |
0 |
0.000 |
| 26 |
29 |
|
[CL]B:66 |
1 |
1 |
125 |
◊ |
A |
x-1/2,y-1/2,z |
5_445 |
2 |
2 |
4754 |
14.5 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.005 |
| 27 |
30 |
|
[5BU]B:3 |
2 |
1 |
442 |
◊ |
B |
x,-y-1,-z |
4_545 |
1 |
1 |
4767 |
12.1 |
-0.7 |
0.297 |
0 |
0 |
0 |
0.003 |
| 28 |
31 |
|
[5BU]B:3 |
1 |
1 |
442 |
◊ |
[5BU]B:3 |
x,-y-1,-z |
4_545 |
1 |
1 |
442 |
9.3 |
-1.0 |
0.238 |
0 |
0 |
0 |
0.002 |
| 29 |
32 |
|
[LIV]A:1001 |
1 |
1 |
946 |
f |
[5BU]A:3 |
x,y,z |
1_555 |
1 |
1 |
442 |
7.4 |
-0.3 |
0.389 |
0 |
0 |
0 |
0.000 |
| 30 |
33 |
|
[LIV]B:2001 |
1 |
1 |
940 |
f |
[5BU]B:3 |
x,y,z |
1_555 |
1 |
1 |
442 |
2.7 |
-0.1 |
0.455 |
0 |
0 |
0 |
0.000 |
| 31 |
34 |
|
[LIV]B:2001 |
1 |
1 |
940 |
◊ |
A |
x-1,y,z |
1_455 |
1 |
1 |
4754 |
1.0 |
-0.1 |
0.482 |
0 |
0 |
0 |
0.000 |
|