| ## |
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 |
160 |
42 |
7016 |
◊ |
A |
x,y,z |
1_555 |
162 |
44 |
6949 |
1497.0 |
-14.6 |
0.091 |
29 |
3 |
0 |
1.000 |
2 |
|
C |
162 |
44 |
6803 |
◊ |
B |
x,y,z |
1_555 |
165 |
43 |
6979 |
1495.5 |
-14.4 |
0.109 |
26 |
4 |
0 |
1.000 |
| Average: |
1496.2 |
-14.5 |
0.100 |
28 |
4 |
0 |
1.000 |
| 2 |
3 |
|
G |
107 |
31 |
6964 |
◊ |
F |
x,y,z |
1_555 |
110 |
29 |
6870 |
890.1 |
-10.0 |
0.191 |
12 |
0 |
0 |
0.681 |
4 |
|
H |
108 |
29 |
6842 |
◊ |
E |
x,y,z |
1_555 |
109 |
27 |
7041 |
888.6 |
-10.9 |
0.136 |
11 |
1 |
0 |
0.681 |
| Average: |
889.4 |
-10.5 |
0.164 |
12 |
1 |
0 |
0.681 |
| 3 |
5 |
|
H |
48 |
15 |
6842 |
◊ |
D |
x,y,z |
1_555 |
48 |
16 |
7016 |
521.9 |
-0.2 |
0.584 |
8 |
3 |
0 |
0.138 |
6 |
|
G |
48 |
16 |
6964 |
◊ |
B |
x,y,z |
1_555 |
49 |
16 |
6979 |
519.7 |
1.6 |
0.768 |
6 |
4 |
0 |
0.138 |
7 |
|
E |
42 |
13 |
7041 |
◊ |
A |
x,y,z |
1_555 |
39 |
12 |
6949 |
457.9 |
-1.1 |
0.542 |
8 |
4 |
0 |
0.138 |
8 |
|
F |
42 |
14 |
6870 |
◊ |
C |
x,y,z |
1_555 |
41 |
12 |
6803 |
404.1 |
-2.0 |
0.479 |
6 |
0 |
0 |
0.138 |
| Average: |
475.9 |
-0.4 |
0.593 |
7 |
3 |
0 |
0.138 |
| 4 |
9 |
|
C |
41 |
11 |
6803 |
◊ |
A |
x,y,z |
1_555 |
39 |
10 |
6949 |
361.0 |
-0.8 |
0.553 |
1 |
0 |
0 |
0.000 |
10 |
|
D |
43 |
11 |
7016 |
◊ |
B |
x,y,z |
1_555 |
42 |
12 |
6979 |
360.3 |
-2.6 |
0.387 |
1 |
0 |
0 |
0.000 |
| Average: |
360.7 |
-1.7 |
0.470 |
1 |
0 |
0 |
0.000 |
| 5 |
11 |
|
E |
39 |
9 |
7041 |
◊ |
G |
x,y-1,z-1 |
1_544 |
36 |
8 |
6964 |
316.9 |
-3.4 |
0.314 |
1 |
0 |
0 |
0.000 |
12 |
|
F |
33 |
10 |
6870 |
◊ |
H |
x-1,y+1,z+1 |
1_466 |
26 |
6 |
6842 |
253.1 |
-2.9 |
0.318 |
1 |
0 |
0 |
0.000 |
| Average: |
285.0 |
-3.1 |
0.316 |
1 |
0 |
0 |
0.000 |
| 6 |
13 |
|
[COA]F:201 |
21 |
1 |
906 |
◊ |
C |
x,y,z |
1_555 |
30 |
12 |
6803 |
223.1 |
2.9 |
0.718 |
3 |
0 |
0 |
0.000 |
14 |
|
[COA]E:201 |
20 |
1 |
906 |
◊ |
A |
x,y,z |
1_555 |
30 |
12 |
6949 |
205.8 |
3.0 |
0.685 |
3 |
0 |
0 |
0.000 |
| Average: |
214.5 |
3.0 |
0.702 |
3 |
0 |
0 |
0.000 |
| 7 |
15 |
|
F |
27 |
8 |
6870 |
◊ |
B |
x,y,z |
1_555 |
24 |
9 |
6979 |
222.8 |
-4.5 |
0.094 |
2 |
0 |
0 |
0.160 |
16 |
|
H |
23 |
8 |
6842 |
◊ |
A |
x,y,z |
1_555 |
22 |
8 |
6949 |
217.5 |
-4.1 |
0.087 |
2 |
0 |
0 |
0.160 |
17 |
|
E |
23 |
8 |
7041 |
◊ |
D |
x,y,z |
1_555 |
23 |
7 |
7016 |
216.9 |
-3.9 |
0.108 |
2 |
0 |
0 |
0.160 |
18 |
|
G |
22 |
8 |
6964 |
◊ |
C |
x,y,z |
1_555 |
21 |
7 |
6803 |
211.1 |
-4.0 |
0.085 |
2 |
0 |
0 |
0.160 |
| Average: |
217.1 |
-4.1 |
0.094 |
2 |
0 |
0 |
0.160 |
| 8 |
19 |
|
[COA]G:201 |
23 |
1 |
911 |
◊ |
C |
x,y,z |
1_555 |
27 |
10 |
6803 |
222.5 |
1.0 |
0.288 |
3 |
0 |
0 |
0.006 |
20 |
|
[COA]H:201 |
23 |
1 |
903 |
◊ |
A |
x,y,z |
1_555 |
27 |
10 |
6949 |
215.8 |
1.0 |
0.311 |
2 |
0 |
0 |
0.006 |
| Average: |
219.2 |
1.0 |
0.300 |
3 |
0 |
0 |
0.006 |
| 9 |
21 |
|
[COA]H:201 |
22 |
1 |
903 |
f |
H |
x,y,z |
1_555 |
19 |
6 |
6842 |
196.7 |
0.2 |
0.593 |
9 |
0 |
0 |
0.171 |
22 |
|
[COA]G:201 |
23 |
1 |
911 |
f |
G |
x,y,z |
1_555 |
18 |
6 |
6964 |
192.1 |
0.1 |
0.586 |
9 |
0 |
0 |
0.171 |
| Average: |
194.4 |
0.2 |
0.589 |
9 |
0 |
0 |
0.171 |
| 10 |
23 |
|
[COA]E:201 |
18 |
1 |
906 |
◊ |
D |
x,y,z |
1_555 |
24 |
9 |
7016 |
195.1 |
0.1 |
0.275 |
3 |
0 |
0 |
0.020 |
24 |
|
[COA]F:201 |
18 |
1 |
906 |
◊ |
B |
x,y,z |
1_555 |
23 |
9 |
6979 |
191.2 |
0.1 |
0.263 |
3 |
0 |
0 |
0.020 |
| Average: |
193.2 |
0.1 |
0.269 |
3 |
0 |
0 |
0.020 |
| 11 |
25 |
|
[COA]G:201 |
17 |
1 |
911 |
◊ |
B |
x,y,z |
1_555 |
27 |
12 |
6979 |
189.4 |
2.8 |
0.659 |
3 |
0 |
0 |
0.000 |
26 |
|
[COA]H:201 |
17 |
1 |
903 |
◊ |
D |
x,y,z |
1_555 |
26 |
11 |
7016 |
182.1 |
2.8 |
0.647 |
3 |
0 |
0 |
0.000 |
| Average: |
185.8 |
2.8 |
0.653 |
3 |
0 |
0 |
0.000 |
| 12 |
27 |
|
F |
19 |
6 |
6870 |
◊ |
G |
x-1,y,z |
1_455 |
20 |
6 |
6964 |
186.8 |
0.7 |
0.727 |
4 |
0 |
0 |
0.000 |
28 |
|
E |
20 |
7 |
7041 |
◊ |
H |
x-1,y,z |
1_455 |
19 |
6 |
6842 |
174.9 |
0.5 |
0.708 |
3 |
0 |
0 |
0.000 |
| Average: |
180.9 |
0.6 |
0.718 |
4 |
0 |
0 |
0.000 |
| 13 |
29 |
|
[COA]E:201 |
19 |
1 |
906 |
f |
E |
x,y,z |
1_555 |
17 |
6 |
7041 |
167.4 |
-0.6 |
0.500 |
7 |
0 |
0 |
0.158 |
30 |
|
[COA]F:201 |
17 |
1 |
906 |
f |
F |
x,y,z |
1_555 |
14 |
6 |
6870 |
164.4 |
-0.9 |
0.403 |
6 |
0 |
0 |
0.158 |
| Average: |
165.9 |
-0.7 |
0.452 |
7 |
0 |
0 |
0.158 |
| 14 |
31 |
|
G |
15 |
5 |
6964 |
◊ |
E |
x-1,y+1,z+1 |
1_466 |
12 |
5 |
7041 |
142.8 |
-0.1 |
0.590 |
2 |
0 |
0 |
0.000 |
32 |
|
H |
16 |
5 |
6842 |
◊ |
F |
x,y-1,z-1 |
1_544 |
13 |
5 |
6870 |
136.9 |
-0.3 |
0.575 |
1 |
0 |
0 |
0.000 |
| Average: |
139.8 |
-0.2 |
0.582 |
2 |
0 |
0 |
0.000 |
| 15 |
33 |
|
D |
11 |
3 |
7016 |
◊ |
G |
x,y,z-1 |
1_554 |
17 |
7 |
6964 |
129.7 |
2.3 |
0.810 |
4 |
6 |
0 |
0.000 |
| 16 |
34 |
|
F |
12 |
3 |
6870 |
◊ |
E |
x-1,y+1,z+1 |
1_466 |
17 |
5 |
7041 |
117.8 |
-2.7 |
0.136 |
0 |
0 |
0 |
0.000 |
35 |
|
E |
11 |
3 |
7041 |
◊ |
F |
x,y-1,z-1 |
1_544 |
15 |
4 |
6870 |
111.0 |
-2.5 |
0.124 |
0 |
0 |
0 |
0.000 |
| Average: |
114.4 |
-2.6 |
0.130 |
0 |
0 |
0 |
0.000 |
| 17 |
36 |
|
[COA]F:201 |
11 |
1 |
906 |
◊ |
G |
x-1,y,z |
1_455 |
6 |
1 |
6964 |
78.6 |
1.2 |
0.702 |
1 |
0 |
0 |
0.000 |
37 |
|
[COA]E:201 |
11 |
1 |
906 |
◊ |
H |
x-1,y,z |
1_455 |
6 |
1 |
6842 |
77.4 |
1.5 |
0.724 |
1 |
0 |
0 |
0.000 |
| Average: |
78.0 |
1.4 |
0.713 |
1 |
0 |
0 |
0.000 |
| 18 |
38 |
|
D |
12 |
5 |
7016 |
◊ |
C |
x,y,z |
1_555 |
11 |
4 |
6803 |
66.2 |
-0.2 |
0.578 |
0 |
0 |
0 |
0.000 |
39 |
|
B |
10 |
5 |
6979 |
◊ |
A |
x,y,z |
1_555 |
9 |
3 |
6949 |
57.0 |
-0.3 |
0.551 |
0 |
0 |
0 |
0.000 |
| Average: |
61.6 |
-0.2 |
0.565 |
0 |
0 |
0 |
0.000 |
| 19 |
40 |
|
B |
8 |
3 |
6979 |
◊ |
G |
x-1,y,z |
1_455 |
9 |
4 |
6964 |
60.0 |
1.0 |
0.790 |
1 |
0 |
0 |
0.000 |
41 |
|
D |
2 |
1 |
7016 |
◊ |
H |
x-1,y,z |
1_455 |
1 |
1 |
6842 |
13.5 |
-0.1 |
0.508 |
0 |
0 |
0 |
0.000 |
| Average: |
36.8 |
0.5 |
0.649 |
1 |
0 |
0 |
0.000 |
| 20 |
42 |
|
[COA]E:201 |
4 |
1 |
906 |
◊ |
[COA]H:201 |
x-1,y,z |
1_455 |
9 |
1 |
903 |
40.2 |
-0.5 |
0.420 |
0 |
0 |
0 |
0.000 |
43 |
|
[COA]F:201 |
6 |
1 |
906 |
◊ |
[COA]G:201 |
x-1,y,z |
1_455 |
8 |
1 |
911 |
38.3 |
-0.5 |
0.428 |
0 |
0 |
0 |
0.000 |
| Average: |
39.2 |
-0.5 |
0.424 |
0 |
0 |
0 |
0.000 |
| 21 |
44 |
|
E |
5 |
1 |
7041 |
◊ |
[COA]H:201 |
x-1,y,z |
1_455 |
7 |
1 |
903 |
38.8 |
0.8 |
0.618 |
0 |
0 |
0 |
0.000 |
45 |
|
F |
5 |
1 |
6870 |
◊ |
[COA]G:201 |
x-1,y,z |
1_455 |
5 |
1 |
911 |
35.5 |
0.4 |
0.515 |
0 |
0 |
0 |
0.000 |
| Average: |
37.1 |
0.6 |
0.567 |
0 |
0 |
0 |
0.000 |
| 22 |
46 |
|
H |
4 |
2 |
6842 |
◊ |
B |
x,y,z-1 |
1_554 |
2 |
1 |
6979 |
12.5 |
0.4 |
0.760 |
0 |
0 |
0 |
0.000 |
| 23 |
47 |
|
E |
1 |
1 |
7041 |
◊ |
A |
x-1,y,z |
1_455 |
1 |
1 |
6949 |
5.0 |
0.2 |
0.804 |
0 |
0 |
0 |
0.000 |
| 24 |
48 |
|
[COA]F:201 |
1 |
1 |
906 |
◊ |
C |
x-1,y,z |
1_455 |
1 |
1 |
6803 |
1.7 |
-0.1 |
0.442 |
0 |
0 |
0 |
0.000 |
|