| ## |
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 |
|
D |
85 |
24 |
6176 |
◊ |
A |
x,y,z |
1_555 |
100 |
31 |
6003 |
841.6 |
-17.8 |
0.759 |
4 |
0 |
0 |
0.938 |
2 |
|
D |
100 |
31 |
6176 |
◊ |
C |
x,y,z |
1_555 |
80 |
22 |
6055 |
836.9 |
-17.6 |
0.724 |
4 |
0 |
0 |
0.938 |
3 |
|
C |
95 |
31 |
6055 |
◊ |
B |
x,y,z |
1_555 |
81 |
22 |
6163 |
833.6 |
-17.6 |
0.685 |
4 |
0 |
0 |
0.938 |
4 |
|
B |
97 |
30 |
6163 |
◊ |
A |
x,y,z |
1_555 |
81 |
22 |
6003 |
815.7 |
-17.1 |
0.730 |
4 |
0 |
0 |
0.938 |
| Average: |
832.0 |
-17.5 |
0.724 |
4 |
0 |
0 |
0.938 |
| 2 |
5 |
|
C |
16 |
5 |
6055 |
◊ |
B |
-x+1,y,-z |
2_655 |
16 |
5 |
6163 |
163.8 |
-4.2 |
0.498 |
0 |
0 |
0 |
0.091 |
6 |
|
D |
16 |
5 |
6176 |
◊ |
A |
-x+1,y,-z |
2_655 |
14 |
5 |
6003 |
163.7 |
-4.1 |
0.459 |
0 |
0 |
0 |
0.091 |
| Average: |
163.7 |
-4.2 |
0.479 |
0 |
0 |
0 |
0.091 |
| 3 |
7 |
|
C |
13 |
5 |
6055 |
◊ |
A |
-x+1,y,-z |
2_655 |
13 |
5 |
6003 |
159.1 |
0.0 |
0.918 |
4 |
0 |
0 |
0.011 |
8 |
|
D |
14 |
5 |
6176 |
◊ |
D |
-x+1,y,-z |
2_655 |
12 |
5 |
6176 |
151.7 |
1.6 |
0.969 |
2 |
0 |
0 |
0.011 |
9 |
|
B |
14 |
5 |
6163 |
◊ |
B |
-x+1,y,-z |
2_655 |
13 |
5 |
6163 |
150.9 |
1.7 |
0.969 |
2 |
0 |
0 |
0.011 |
| Average: |
153.9 |
1.1 |
0.952 |
3 |
0 |
0 |
0.011 |
| 4 |
10 |
|
[TBA]A:129 |
6 |
1 |
318 |
f |
A |
x,y,z |
1_555 |
18 |
7 |
6003 |
92.1 |
-2.3 |
0.852 |
0 |
0 |
0 |
0.100 |
| 5 |
11 |
|
B |
10 |
2 |
6163 |
◊ |
B |
-x+2,y,-z+1 |
2_756 |
10 |
2 |
6163 |
73.6 |
-0.5 |
0.855 |
0 |
0 |
0 |
0.000 |
| 6 |
12 |
|
[TBA]A:129 |
6 |
1 |
318 |
◊ |
B |
x,y,z |
1_555 |
13 |
5 |
6163 |
61.6 |
-1.4 |
0.888 |
0 |
0 |
0 |
0.017 |
| 7 |
13 |
|
[TBA]A:129 |
6 |
1 |
318 |
◊ |
D |
x,y,z |
1_555 |
10 |
5 |
6176 |
51.2 |
-1.1 |
0.904 |
0 |
0 |
0 |
0.013 |
| 8 |
14 |
|
[RB]A:126 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
6055 |
47.7 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.083 |
15 |
|
[RB]A:126 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
6163 |
47.5 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.083 |
16 |
|
[RB]A:126 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
8 |
4 |
6176 |
47.4 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.083 |
17 |
|
[RB]A:126 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
8 |
4 |
6003 |
46.4 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.083 |
| Average: |
47.3 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.083 |
| 9 |
18 |
|
[RB]A:127 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
12 |
4 |
6003 |
39.9 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.135 |
19 |
|
[RB]A:127 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
10 |
4 |
6176 |
38.8 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.135 |
20 |
|
[RB]A:127 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
10 |
4 |
6163 |
38.6 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.135 |
21 |
|
[RB]A:127 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
9 |
3 |
6055 |
38.2 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.135 |
22 |
|
[RB]A:128 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
9 |
3 |
6163 |
36.8 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.135 |
23 |
|
[RB]A:128 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
9 |
3 |
6003 |
36.5 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.135 |
24 |
|
[RB]A:128 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
9 |
3 |
6055 |
36.4 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.135 |
25 |
|
[RB]A:128 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
9 |
3 |
6176 |
35.8 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.135 |
| Average: |
37.6 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.135 |
| 10 |
26 |
|
[TBA]A:129 |
4 |
1 |
318 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
6055 |
32.3 |
-0.1 |
0.898 |
0 |
0 |
0 |
0.001 |
| 11 |
27 |
|
[RB]A:128 |
1 |
1 |
216 |
f |
[RB]A:127 |
x,y,z |
1_555 |
1 |
1 |
216 |
31.8 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.061 |
| 12 |
28 |
|
[TBA]A:129 |
5 |
1 |
318 |
◊ |
[RB]A:128 |
x,y,z |
1_555 |
1 |
1 |
216 |
30.5 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.010 |
| 13 |
29 |
|
[RB]A:127 |
1 |
1 |
216 |
f |
[RB]A:126 |
x,y,z |
1_555 |
1 |
1 |
216 |
20.4 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.039 |
| 14 |
30 |
|
C |
6 |
5 |
6055 |
◊ |
A |
x,y,z |
1_555 |
6 |
5 |
6003 |
16.9 |
-0.2 |
0.858 |
0 |
0 |
0 |
0.002 |
31 |
|
D |
4 |
4 |
6176 |
◊ |
B |
x,y,z |
1_555 |
4 |
4 |
6163 |
9.3 |
0.0 |
0.865 |
0 |
0 |
0 |
0.002 |
| Average: |
13.1 |
-0.1 |
0.861 |
0 |
0 |
0 |
0.002 |
|