| ## |
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 |
|
B |
59 |
16 |
12745 |
◊ |
A |
x,y,z |
1_555 |
48 |
13 |
12608 |
466.1 |
3.0 |
0.794 |
5 |
3 |
0 |
0.000 |
2 |
|
E |
61 |
15 |
12731 |
◊ |
D |
x,y,z |
1_555 |
47 |
13 |
12853 |
458.7 |
3.2 |
0.799 |
6 |
2 |
0 |
0.000 |
3 |
|
C |
46 |
13 |
12656 |
◊ |
D |
x-1,y-1,z |
1_445 |
62 |
15 |
12853 |
455.3 |
3.2 |
0.802 |
7 |
2 |
0 |
0.000 |
4 |
|
B |
46 |
13 |
12745 |
◊ |
F |
x,y-1,z |
1_545 |
61 |
15 |
12610 |
439.3 |
2.9 |
0.798 |
5 |
2 |
0 |
0.000 |
5 |
|
A |
60 |
14 |
12608 |
◊ |
F |
x,y-1,z |
1_545 |
45 |
13 |
12610 |
438.0 |
2.7 |
0.788 |
6 |
2 |
0 |
0.000 |
6 |
|
C |
57 |
15 |
12656 |
◊ |
E |
x-1,y-1,z |
1_445 |
46 |
13 |
12731 |
436.9 |
2.1 |
0.763 |
4 |
3 |
0 |
0.000 |
| Average: |
449.1 |
2.9 |
0.791 |
6 |
2 |
0 |
0.000 |
| 2 |
7 |
|
A |
35 |
11 |
12608 |
◊ |
E |
x-1,y-1,z |
1_445 |
27 |
9 |
12731 |
309.1 |
-7.5 |
0.022 |
2 |
0 |
0 |
0.000 |
8 |
|
C |
30 |
9 |
12656 |
◊ |
F |
x,y-1,z |
1_545 |
24 |
8 |
12610 |
295.7 |
-7.6 |
0.015 |
2 |
0 |
0 |
0.000 |
9 |
|
C |
22 |
8 |
12656 |
◊ |
F |
x-1,y-1,z |
1_445 |
32 |
9 |
12610 |
294.9 |
-7.8 |
0.013 |
2 |
0 |
0 |
0.000 |
10 |
|
E |
32 |
10 |
12731 |
◊ |
A |
x,y,z |
1_555 |
24 |
8 |
12608 |
293.8 |
-7.4 |
0.017 |
2 |
0 |
0 |
0.000 |
11 |
|
B |
25 |
8 |
12745 |
◊ |
D |
x,y-1,z |
1_545 |
31 |
9 |
12853 |
292.0 |
-7.3 |
0.019 |
2 |
0 |
0 |
0.000 |
12 |
|
D |
25 |
8 |
12853 |
◊ |
B |
x,y,z |
1_555 |
31 |
9 |
12745 |
290.5 |
-7.3 |
0.018 |
2 |
0 |
0 |
0.000 |
| Average: |
296.0 |
-7.5 |
0.017 |
2 |
0 |
0 |
0.000 |
| 3 |
13 |
|
E |
28 |
10 |
12731 |
◊ |
D |
x,y-1,z |
1_545 |
22 |
7 |
12853 |
245.3 |
0.8 |
0.668 |
1 |
1 |
0 |
0.000 |
14 |
|
E |
23 |
6 |
12731 |
◊ |
C |
x,y,z |
1_555 |
27 |
10 |
12656 |
209.6 |
0.6 |
0.625 |
2 |
2 |
0 |
0.000 |
15 |
|
F |
24 |
9 |
12610 |
◊ |
B |
x,y,z |
1_555 |
21 |
7 |
12745 |
208.0 |
1.0 |
0.697 |
2 |
1 |
0 |
0.000 |
16 |
|
A |
14 |
6 |
12608 |
◊ |
B |
x-1,y-1,z |
1_445 |
22 |
9 |
12745 |
153.8 |
1.7 |
0.791 |
0 |
0 |
0 |
0.000 |
17 |
|
C |
18 |
7 |
12656 |
◊ |
D |
x,y-1,z |
1_545 |
18 |
7 |
12853 |
148.2 |
0.9 |
0.709 |
0 |
1 |
0 |
0.000 |
18 |
|
A |
18 |
8 |
12608 |
◊ |
F |
x-1,y-1,z |
1_445 |
14 |
6 |
12610 |
132.0 |
0.7 |
0.690 |
0 |
1 |
0 |
0.000 |
| Average: |
182.8 |
0.9 |
0.697 |
1 |
1 |
0 |
0.000 |
| 4 |
19 |
|
[BGC]F:401 |
10 |
1 |
302 |
◊ |
F |
x,y,z |
1_555 |
22 |
10 |
12610 |
155.4 |
2.2 |
0.406 |
1 |
0 |
0 |
0.000 |
| 5 |
20 |
|
[BGC]B:401 |
10 |
1 |
304 |
◊ |
B |
x,y,z |
1_555 |
22 |
10 |
12745 |
148.0 |
2.7 |
0.464 |
0 |
0 |
0 |
0.000 |
| 6 |
21 |
|
E |
16 |
6 |
12731 |
◊ |
A |
x,y,z-1 |
1_554 |
15 |
6 |
12608 |
129.5 |
-0.4 |
0.396 |
0 |
1 |
0 |
0.000 |
| 7 |
22 |
|
D |
13 |
4 |
12853 |
◊ |
F |
x,y,z-1 |
1_554 |
10 |
5 |
12610 |
101.0 |
-0.3 |
0.513 |
0 |
1 |
0 |
0.000 |
| 8 |
23 |
|
C |
14 |
8 |
12656 |
◊ |
A |
x,y,z-1 |
1_554 |
12 |
7 |
12608 |
93.2 |
-0.7 |
0.463 |
0 |
0 |
0 |
0.000 |
| 9 |
24 |
|
C |
8 |
2 |
12656 |
◊ |
B |
x-1,y-1,z-1 |
1_444 |
14 |
5 |
12745 |
81.8 |
-0.5 |
0.497 |
0 |
0 |
0 |
0.000 |
| 10 |
25 |
|
[CL]C:402 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
9 |
6 |
12656 |
64.0 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.100 |
26 |
|
[CL]A:403 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
6 |
5 |
12608 |
63.7 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.100 |
| Average: |
63.9 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.100 |
| 11 |
27 |
|
E |
13 |
5 |
12731 |
◊ |
B |
x,y,z-1 |
1_554 |
11 |
6 |
12745 |
58.0 |
0.3 |
0.598 |
0 |
0 |
0 |
0.000 |
| 12 |
28 |
|
A |
4 |
2 |
12608 |
◊ |
B |
x-1,y,z |
1_455 |
8 |
3 |
12745 |
54.9 |
1.4 |
0.832 |
1 |
2 |
0 |
0.000 |
29 |
|
D |
3 |
1 |
12853 |
◊ |
E |
x-1,y,z |
1_455 |
7 |
3 |
12731 |
53.5 |
1.7 |
0.896 |
1 |
1 |
0 |
0.000 |
30 |
|
C |
7 |
4 |
12656 |
◊ |
E |
x-1,y,z |
1_455 |
4 |
2 |
12731 |
52.4 |
0.6 |
0.724 |
1 |
2 |
0 |
0.000 |
31 |
|
D |
8 |
3 |
12853 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
12656 |
47.7 |
0.8 |
0.800 |
1 |
2 |
0 |
0.000 |
32 |
|
F |
5 |
3 |
12610 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
2 |
12745 |
45.7 |
0.8 |
0.797 |
1 |
2 |
0 |
0.000 |
33 |
|
F |
3 |
1 |
12610 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
12608 |
25.5 |
-0.2 |
0.421 |
0 |
0 |
0 |
0.000 |
| Average: |
46.6 |
0.9 |
0.745 |
1 |
2 |
0 |
0.000 |
| 13 |
34 |
|
C |
9 |
4 |
12656 |
◊ |
B |
x-1,y,z |
1_455 |
8 |
4 |
12745 |
46.0 |
-0.9 |
0.380 |
0 |
0 |
0 |
0.000 |
35 |
|
D |
8 |
4 |
12853 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
12608 |
42.8 |
-0.8 |
0.397 |
0 |
0 |
0 |
0.000 |
36 |
|
F |
9 |
4 |
12610 |
◊ |
E |
x-1,y,z |
1_455 |
6 |
4 |
12731 |
41.6 |
-0.8 |
0.379 |
0 |
0 |
0 |
0.000 |
| Average: |
43.4 |
-0.8 |
0.385 |
0 |
0 |
0 |
0.000 |
| 14 |
37 |
|
C |
10 |
6 |
12656 |
◊ |
A |
x,y,z |
1_555 |
5 |
4 |
12608 |
35.3 |
1.3 |
0.831 |
0 |
0 |
0 |
0.000 |
38 |
|
F |
3 |
3 |
12610 |
◊ |
D |
x,y,z |
1_555 |
3 |
3 |
12853 |
26.8 |
1.3 |
0.910 |
0 |
0 |
0 |
0.000 |
39 |
|
E |
3 |
3 |
12731 |
◊ |
B |
x,y,z |
1_555 |
3 |
3 |
12745 |
17.3 |
0.9 |
0.861 |
0 |
0 |
0 |
0.000 |
| Average: |
26.5 |
1.2 |
0.867 |
0 |
0 |
0 |
0.000 |
| 15 |
40 |
|
C |
5 |
3 |
12656 |
◊ |
F |
x-1,y-1,z-1 |
1_444 |
6 |
3 |
12610 |
25.3 |
0.6 |
0.670 |
0 |
0 |
0 |
0.000 |
| 16 |
41 |
|
C |
2 |
1 |
12656 |
f |
[BGC]F:401 |
x-1,y-1,z |
1_445 |
2 |
1 |
302 |
11.8 |
-0.0 |
0.297 |
0 |
0 |
0 |
0.000 |
| 17 |
42 |
|
[BGC]B:401 |
1 |
1 |
304 |
f |
D |
x,y,z |
1_555 |
2 |
1 |
12853 |
8.1 |
-0.0 |
0.256 |
0 |
0 |
0 |
0.100 |
|