## |
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 |
247 |
70 |
14132 |
◊ |
A |
x,y,z |
1_555 |
251 |
71 |
14123 |
2421.1 |
-56.1 |
0.726 |
8 |
2 |
1 |
1.000 |
2 |
|
D |
248 |
71 |
14139 |
◊ |
C |
x,y,z |
1_555 |
250 |
71 |
14133 |
2410.3 |
-56.1 |
0.722 |
8 |
2 |
1 |
1.000 |
Average: |
2415.7 |
-56.1 |
0.724 |
8 |
2 |
1 |
1.000 |
2 |
3 |
|
[UND]C:301 |
11 |
1 |
410 |
◊ |
C |
x,y,z |
1_555 |
25 |
13 |
14133 |
185.1 |
2.1 |
0.152 |
0 |
0 |
0 |
0.000 |
4 |
|
[UND]D:301 |
11 |
1 |
409 |
◊ |
D |
x,y,z |
1_555 |
26 |
13 |
14139 |
183.5 |
2.1 |
0.148 |
0 |
0 |
0 |
0.000 |
5 |
|
[UND]B:301 |
11 |
1 |
408 |
◊ |
B |
x,y,z |
1_555 |
25 |
13 |
14132 |
182.5 |
2.1 |
0.153 |
0 |
0 |
0 |
0.000 |
6 |
|
[UND]A:301 |
11 |
1 |
408 |
◊ |
A |
x,y,z |
1_555 |
25 |
13 |
14123 |
182.3 |
2.1 |
0.154 |
0 |
0 |
0 |
0.000 |
Average: |
183.3 |
2.1 |
0.152 |
0 |
0 |
0 |
0.000 |
3 |
7 |
|
[UND]A:301 |
6 |
1 |
408 |
◊ |
B |
x,y,z |
1_555 |
11 |
5 |
14132 |
88.8 |
1.6 |
0.205 |
0 |
0 |
0 |
0.000 |
8 |
|
[UND]C:301 |
6 |
1 |
410 |
◊ |
D |
x,y,z |
1_555 |
10 |
5 |
14139 |
88.7 |
1.7 |
0.195 |
0 |
0 |
0 |
0.000 |
9 |
|
[UND]B:301 |
7 |
1 |
408 |
◊ |
A |
x,y,z |
1_555 |
10 |
5 |
14123 |
88.6 |
1.7 |
0.188 |
0 |
0 |
0 |
0.000 |
10 |
|
[UND]D:301 |
7 |
1 |
409 |
◊ |
C |
x,y,z |
1_555 |
10 |
5 |
14133 |
88.6 |
1.7 |
0.184 |
0 |
0 |
0 |
0.000 |
Average: |
88.7 |
1.7 |
0.193 |
0 |
0 |
0 |
0.000 |
4 |
11 |
|
[K]A:5 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
18 |
9 |
14132 |
79.9 |
-44.6 |
0.000 |
0 |
0 |
0 |
0.148 |
12 |
|
[K]C:5 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
18 |
9 |
14139 |
79.4 |
-44.3 |
0.000 |
0 |
0 |
0 |
0.148 |
13 |
|
[K]A:5 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
18 |
9 |
14123 |
79.0 |
-43.5 |
0.000 |
0 |
0 |
0 |
0.148 |
14 |
|
[K]C:5 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
19 |
9 |
14133 |
78.4 |
-43.6 |
0.000 |
0 |
0 |
0 |
0.148 |
Average: |
79.2 |
-44.0 |
0.000 |
0 |
0 |
0 |
0.148 |
5 |
15 |
|
[K]C:1 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
10 |
7 |
14139 |
56.1 |
-36.3 |
0.000 |
0 |
0 |
0 |
0.121 |
16 |
|
[K]A:1 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
11 |
8 |
14132 |
55.6 |
-36.0 |
0.000 |
0 |
0 |
0 |
0.121 |
17 |
|
[K]A:1 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
10 |
8 |
14123 |
55.6 |
-35.9 |
0.000 |
0 |
0 |
0 |
0.121 |
18 |
|
[K]C:1 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
11 |
8 |
14133 |
54.9 |
-35.3 |
0.000 |
0 |
0 |
0 |
0.121 |
Average: |
55.6 |
-35.9 |
0.000 |
0 |
0 |
0 |
0.121 |
6 |
19 |
|
[K]C:4 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
13 |
5 |
14133 |
55.4 |
-35.3 |
0.000 |
0 |
0 |
0 |
0.118 |
20 |
|
[K]A:4 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
13 |
5 |
14132 |
55.2 |
-35.4 |
0.000 |
0 |
0 |
0 |
0.118 |
21 |
|
[K]A:4 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
13 |
5 |
14123 |
54.7 |
-34.9 |
0.000 |
0 |
0 |
0 |
0.118 |
22 |
|
[K]C:4 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
13 |
5 |
14139 |
54.3 |
-34.7 |
0.000 |
0 |
0 |
0 |
0.118 |
Average: |
54.9 |
-35.1 |
0.000 |
0 |
0 |
0 |
0.118 |
7 |
23 |
|
[K]C:3 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
15 |
6 |
14139 |
53.5 |
-35.4 |
0.000 |
0 |
0 |
0 |
0.119 |
24 |
|
[K]C:3 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
15 |
6 |
14133 |
53.5 |
-35.3 |
0.000 |
0 |
0 |
0 |
0.119 |
25 |
|
[K]A:3 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
15 |
6 |
14123 |
53.0 |
-35.1 |
0.000 |
0 |
0 |
0 |
0.119 |
Average: |
53.3 |
-35.3 |
0.000 |
0 |
0 |
0 |
0.119 |
8 |
26 |
|
[K]A:3 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
15 |
6 |
14132 |
53.3 |
-35.2 |
0.000 |
0 |
0 |
0 |
0.178 |
27 |
|
[K]A:2 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
13 |
8 |
14123 |
53.3 |
-35.5 |
0.000 |
0 |
0 |
0 |
0.178 |
28 |
|
[K]C:2 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
14 |
8 |
14133 |
53.2 |
-35.4 |
0.000 |
0 |
0 |
0 |
0.178 |
29 |
|
[K]C:2 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
14 |
8 |
14139 |
53.1 |
-35.3 |
0.000 |
0 |
0 |
0 |
0.178 |
30 |
|
[K]A:2 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
13 |
8 |
14132 |
52.7 |
-35.1 |
0.000 |
0 |
0 |
0 |
0.178 |
Average: |
53.1 |
-35.3 |
0.000 |
0 |
0 |
0 |
0.178 |
9 |
31 |
|
[K]A:4 |
1 |
1 |
216 |
f |
[K]A:3 |
x,y,z |
1_555 |
1 |
1 |
216 |
34.0 |
-34.0 |
0.000 |
0 |
0 |
0 |
0.057 |
10 |
32 |
|
[K]C:4 |
1 |
1 |
216 |
f |
[K]C:3 |
x,y,z |
1_555 |
1 |
1 |
216 |
34.0 |
-34.0 |
0.000 |
0 |
0 |
0 |
0.057 |
11 |
33 |
|
[K]C:2 |
1 |
1 |
216 |
f |
[K]C:1 |
x,y,z |
1_555 |
1 |
1 |
216 |
33.8 |
-33.8 |
0.000 |
0 |
0 |
0 |
0.057 |
12 |
34 |
|
[K]A:2 |
1 |
1 |
216 |
f |
[K]A:1 |
x,y,z |
1_555 |
1 |
1 |
216 |
33.7 |
-33.7 |
0.000 |
0 |
0 |
0 |
0.057 |
13 |
35 |
|
[UND]D:301 |
3 |
1 |
409 |
f |
[UND]C:301 |
x,y,z |
1_555 |
3 |
1 |
410 |
33.6 |
0.9 |
0.023 |
0 |
0 |
0 |
0.000 |
36 |
|
[UND]B:301 |
3 |
1 |
408 |
f |
[UND]A:301 |
x,y,z |
1_555 |
3 |
1 |
408 |
33.1 |
0.8 |
0.023 |
0 |
0 |
0 |
0.000 |
Average: |
33.4 |
0.9 |
0.023 |
0 |
0 |
0 |
0.000 |
14 |
37 |
|
[K]A:3 |
1 |
1 |
216 |
f |
[K]A:2 |
x,y,z |
1_555 |
1 |
1 |
216 |
33.5 |
-33.5 |
0.000 |
0 |
0 |
0 |
0.056 |
15 |
38 |
|
[K]C:3 |
1 |
1 |
216 |
f |
[K]C:2 |
x,y,z |
1_555 |
1 |
1 |
216 |
33.0 |
-33.0 |
0.000 |
0 |
0 |
0 |
0.055 |
16 |
39 |
|
[K]C:5 |
1 |
1 |
216 |
f |
[K]C:1 |
x,y,z |
1_555 |
1 |
1 |
216 |
33.0 |
-33.0 |
0.000 |
0 |
0 |
0 |
0.055 |
17 |
40 |
|
[K]A:5 |
1 |
1 |
216 |
f |
[K]A:1 |
x,y,z |
1_555 |
1 |
1 |
216 |
32.6 |
-32.6 |
0.000 |
0 |
0 |
0 |
0.055 |
18 |
41 |
|
[K]C:4 |
1 |
1 |
216 |
f |
[UND]C:301 |
x,y,z |
1_555 |
4 |
1 |
410 |
19.2 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.024 |
42 |
|
[K]C:4 |
1 |
1 |
216 |
f |
[UND]D:301 |
x,y,z |
1_555 |
4 |
1 |
409 |
18.8 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.024 |
43 |
|
[K]A:4 |
1 |
1 |
216 |
f |
[UND]A:301 |
x,y,z |
1_555 |
4 |
1 |
408 |
18.6 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.024 |
44 |
|
[K]A:4 |
1 |
1 |
216 |
f |
[UND]B:301 |
x,y,z |
1_555 |
4 |
1 |
408 |
18.6 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.024 |
Average: |
18.8 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.024 |
19 |
45 |
|
[K]C:3 |
1 |
1 |
216 |
f |
[K]C:1 |
x,y,z |
1_555 |
1 |
1 |
216 |
10.5 |
-10.5 |
0.000 |
0 |
0 |
0 |
0.018 |
20 |
46 |
|
[K]A:3 |
1 |
1 |
216 |
f |
[K]A:1 |
x,y,z |
1_555 |
1 |
1 |
216 |
10.2 |
-10.2 |
0.000 |
0 |
0 |
0 |
0.017 |
21 |
47 |
|
[K]A:4 |
1 |
1 |
216 |
f |
[K]A:2 |
x,y,z |
1_555 |
1 |
1 |
216 |
9.7 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.016 |
22 |
48 |
|
[K]C:4 |
1 |
1 |
216 |
f |
[K]C:2 |
x,y,z |
1_555 |
1 |
1 |
216 |
9.4 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.016 |
23 |
49 |
|
[K]A:5 |
1 |
1 |
216 |
f |
[K]A:2 |
x,y,z |
1_555 |
1 |
1 |
216 |
0.6 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.000 |
24 |
50 |
|
[K]C:5 |
1 |
1 |
216 |
f |
[K]C:2 |
x,y,z |
1_555 |
1 |
1 |
216 |
0.6 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.000 |
|