| ## |
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 |
|
K |
111 |
31 |
7840 |
◊ |
I |
x,y,z |
1_555 |
115 |
31 |
7894 |
1045.0 |
-12.8 |
0.306 |
13 |
0 |
0 |
0.643 |
2 |
|
C |
106 |
30 |
7968 |
◊ |
A |
x,y,z |
1_555 |
106 |
30 |
7925 |
1044.5 |
-12.8 |
0.175 |
14 |
0 |
0 |
0.643 |
3 |
|
E |
91 |
26 |
7882 |
◊ |
E |
x,-y+1,-z |
4_565 |
91 |
26 |
7882 |
929.9 |
-11.5 |
0.124 |
16 |
0 |
0 |
0.643 |
4 |
|
G |
90 |
27 |
7821 |
◊ |
G |
x,-y+1,-z |
4_565 |
90 |
27 |
7821 |
920.5 |
-10.9 |
0.188 |
14 |
0 |
0 |
0.643 |
| Average: |
985.0 |
-12.0 |
0.198 |
14 |
0 |
0 |
0.643 |
| 2 |
5 |
|
K |
93 |
29 |
7840 |
◊ |
I |
x,-y+2,-z |
4_575 |
84 |
28 |
7894 |
866.0 |
-6.0 |
0.573 |
13 |
8 |
0 |
1.000 |
6 |
|
C |
87 |
28 |
7968 |
◊ |
C |
-x,y,-z+1/2 |
3_555 |
87 |
28 |
7968 |
857.3 |
-6.5 |
0.348 |
13 |
8 |
0 |
1.000 |
7 |
|
G |
89 |
30 |
7821 |
◊ |
E |
x,y,z |
1_555 |
86 |
29 |
7882 |
848.8 |
-6.1 |
0.361 |
13 |
8 |
0 |
1.000 |
8 |
|
A |
85 |
28 |
7925 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
85 |
28 |
7925 |
842.8 |
-5.9 |
0.514 |
13 |
8 |
0 |
1.000 |
| Average: |
853.7 |
-6.1 |
0.449 |
13 |
8 |
0 |
1.000 |
| 3 |
9 |
|
K |
48 |
11 |
7840 |
◊ |
K |
x,-y+2,-z |
4_575 |
48 |
11 |
7840 |
441.9 |
-6.3 |
0.263 |
4 |
0 |
0 |
0.151 |
10 |
|
C |
49 |
11 |
7968 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
45 |
11 |
7925 |
438.4 |
-5.4 |
0.257 |
3 |
0 |
0 |
0.151 |
11 |
|
I |
50 |
11 |
7894 |
◊ |
I |
x,-y+2,-z |
4_575 |
50 |
11 |
7894 |
434.7 |
-6.1 |
0.295 |
4 |
0 |
0 |
0.151 |
12 |
|
G |
45 |
11 |
7821 |
◊ |
E |
x,-y+1,-z |
4_565 |
48 |
12 |
7882 |
428.6 |
-5.8 |
0.187 |
4 |
0 |
0 |
0.151 |
| Average: |
435.9 |
-5.9 |
0.250 |
4 |
0 |
0 |
0.151 |
| 4 |
13 |
|
K |
48 |
14 |
7840 |
◊ |
C |
x,y,z |
1_555 |
46 |
15 |
7968 |
394.3 |
-1.3 |
0.673 |
5 |
0 |
0 |
0.000 |
| 5 |
14 |
|
G |
29 |
9 |
7821 |
◊ |
A |
x-1,y,z |
1_455 |
41 |
13 |
7925 |
328.3 |
1.2 |
0.828 |
5 |
0 |
0 |
0.000 |
15 |
|
I |
40 |
13 |
7894 |
◊ |
E |
x-1,y,z |
1_455 |
34 |
10 |
7882 |
323.1 |
0.5 |
0.782 |
4 |
0 |
0 |
0.000 |
| Average: |
325.7 |
0.8 |
0.805 |
5 |
0 |
0 |
0.000 |
| 6 |
16 |
|
E |
27 |
7 |
7882 |
◊ |
A |
x,-y+1,-z |
4_565 |
26 |
7 |
7925 |
246.8 |
-2.1 |
0.461 |
3 |
0 |
0 |
0.000 |
17 |
|
I |
26 |
6 |
7894 |
◊ |
G |
x,-y+1,-z |
4_565 |
21 |
6 |
7821 |
226.2 |
-2.8 |
0.373 |
1 |
0 |
0 |
0.000 |
| Average: |
236.5 |
-2.5 |
0.417 |
2 |
0 |
0 |
0.000 |
| 7 |
18 |
|
E |
28 |
12 |
7882 |
◊ |
A |
x,y,z |
1_555 |
24 |
10 |
7925 |
236.1 |
-1.8 |
0.437 |
0 |
0 |
0 |
0.000 |
19 |
|
I |
23 |
10 |
7894 |
◊ |
G |
x,y,z |
1_555 |
29 |
13 |
7821 |
218.5 |
-1.4 |
0.558 |
1 |
1 |
0 |
0.000 |
| Average: |
227.3 |
-1.6 |
0.497 |
1 |
1 |
0 |
0.000 |
| 8 |
20 |
|
E |
22 |
6 |
7882 |
◊ |
C |
x,y,z |
1_555 |
18 |
7 |
7968 |
199.6 |
0.5 |
0.722 |
2 |
0 |
0 |
0.000 |
21 |
|
K |
19 |
7 |
7840 |
◊ |
G |
x,y,z |
1_555 |
23 |
6 |
7821 |
184.8 |
-0.2 |
0.696 |
1 |
0 |
0 |
0.000 |
| Average: |
192.2 |
0.2 |
0.709 |
2 |
0 |
0 |
0.000 |
| 9 |
22 |
|
G |
22 |
6 |
7821 |
◊ |
C |
x,y,z |
1_555 |
20 |
6 |
7968 |
178.7 |
0.4 |
0.705 |
1 |
2 |
0 |
0.000 |
23 |
|
K |
20 |
6 |
7840 |
◊ |
E |
x,y,z |
1_555 |
22 |
6 |
7882 |
177.0 |
-0.4 |
0.610 |
0 |
0 |
0 |
0.000 |
| Average: |
177.9 |
-0.0 |
0.658 |
1 |
1 |
0 |
0.000 |
| 10 |
24 |
|
G |
20 |
5 |
7821 |
◊ |
A |
x,y,z |
1_555 |
19 |
4 |
7925 |
167.3 |
-2.9 |
0.271 |
0 |
0 |
0 |
0.000 |
25 |
|
I |
17 |
4 |
7894 |
◊ |
E |
x,y,z |
1_555 |
18 |
6 |
7882 |
149.3 |
-2.9 |
0.251 |
0 |
0 |
0 |
0.000 |
| Average: |
158.3 |
-2.9 |
0.261 |
0 |
0 |
0 |
0.000 |
| 11 |
26 |
|
C |
18 |
6 |
7968 |
◊ |
A |
x-1,y,z |
1_455 |
18 |
7 |
7925 |
148.7 |
-0.3 |
0.478 |
0 |
0 |
0 |
0.000 |
27 |
|
I |
12 |
6 |
7894 |
◊ |
K |
x-1,y,z |
1_455 |
14 |
5 |
7840 |
97.0 |
-0.6 |
0.507 |
0 |
0 |
0 |
0.000 |
| Average: |
122.9 |
-0.5 |
0.493 |
0 |
0 |
0 |
0.000 |
| 12 |
28 |
|
G |
9 |
4 |
7821 |
◊ |
E |
x-1,y,z |
1_455 |
13 |
3 |
7882 |
100.7 |
-0.5 |
0.546 |
0 |
0 |
0 |
0.000 |
| 13 |
29 |
|
[CL]K:201 |
1 |
1 |
125 |
f |
K |
x,y,z |
1_555 |
11 |
6 |
7840 |
54.8 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.445 |
30 |
|
[CL]A:201 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
7925 |
51.9 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.445 |
31 |
|
[CL]E:201 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
11 |
6 |
7882 |
50.4 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.445 |
32 |
|
[CL]G:201 |
1 |
1 |
125 |
f |
G |
x,y,z |
1_555 |
12 |
6 |
7821 |
49.6 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.445 |
| Average: |
51.7 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.445 |
| 14 |
33 |
|
[CL]G:201 |
1 |
1 |
125 |
◊ |
G |
x,-y+1,-z |
4_565 |
5 |
4 |
7821 |
36.8 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.176 |
34 |
|
[CL]E:201 |
1 |
1 |
125 |
◊ |
E |
x,-y+1,-z |
4_565 |
5 |
4 |
7882 |
35.7 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.176 |
35 |
|
[CL]A:201 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
5 |
4 |
7968 |
34.9 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.176 |
36 |
|
[CL]K:201 |
1 |
1 |
125 |
◊ |
I |
x,y,z |
1_555 |
5 |
4 |
7894 |
28.5 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.176 |
| Average: |
34.0 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.176 |
| 15 |
37 |
|
[CL]G:201 |
1 |
1 |
125 |
◊ |
E |
x,y,z |
1_555 |
9 |
1 |
7882 |
25.3 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.168 |
38 |
|
[CL]A:201 |
1 |
1 |
125 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
9 |
1 |
7925 |
24.4 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.168 |
39 |
|
[CL]E:201 |
1 |
1 |
125 |
◊ |
G |
x,y,z |
1_555 |
9 |
1 |
7821 |
23.2 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.168 |
40 |
|
[CL]K:201 |
1 |
1 |
125 |
◊ |
I |
x,-y+2,-z |
4_575 |
9 |
1 |
7894 |
19.8 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.168 |
| Average: |
23.2 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.168 |
|