## |
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 |
311 |
80 |
11173 |
◊ |
A |
x,y,z |
1_555 |
307 |
78 |
11100 |
3108.4 |
-50.0 |
0.037 |
24 |
13 |
0 |
0.628 |
2 |
|
D |
304 |
80 |
11099 |
◊ |
C |
x,y,z |
1_555 |
293 |
76 |
10974 |
2968.7 |
-52.0 |
0.089 |
19 |
6 |
0 |
0.628 |
Average: |
3038.5 |
-51.0 |
0.063 |
22 |
10 |
0 |
0.628 |
2 |
3 |
|
D |
74 |
17 |
11099 |
◊ |
B |
x-1,y,z |
1_455 |
72 |
16 |
11173 |
572.5 |
-5.0 |
0.705 |
9 |
0 |
0 |
0.004 |
3 |
4 |
|
C |
37 |
10 |
10974 |
◊ |
A |
x-1,y+1,z |
1_465 |
45 |
15 |
11100 |
385.4 |
-4.4 |
0.479 |
2 |
0 |
0 |
0.000 |
4 |
5 |
|
D |
32 |
7 |
11099 |
◊ |
A |
x,y,z |
1_555 |
34 |
8 |
11100 |
276.7 |
-3.3 |
0.550 |
2 |
0 |
0 |
0.000 |
5 |
6 |
|
B |
24 |
8 |
11173 |
◊ |
D |
x,y-1,z+1 |
1_546 |
23 |
8 |
11099 |
221.2 |
-2.3 |
0.555 |
1 |
2 |
0 |
0.000 |
6 |
7 |
|
C |
12 |
8 |
10974 |
◊ |
B |
x-1,y,z |
1_455 |
8 |
2 |
11173 |
120.4 |
-1.1 |
0.219 |
1 |
0 |
0 |
0.001 |
8 |
|
D |
9 |
2 |
11099 |
◊ |
A |
x-1,y,z |
1_455 |
14 |
9 |
11100 |
119.9 |
-0.8 |
0.323 |
1 |
0 |
0 |
0.001 |
Average: |
120.1 |
-0.9 |
0.271 |
1 |
0 |
0 |
0.001 |
7 |
9 |
|
B |
14 |
4 |
11173 |
◊ |
A |
x-1,y,z |
1_455 |
13 |
3 |
11100 |
107.4 |
-1.5 |
0.479 |
1 |
0 |
0 |
0.000 |
8 |
10 |
|
[EDO]C:301 |
4 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
12 |
6 |
10974 |
103.1 |
3.6 |
0.584 |
3 |
0 |
0 |
0.000 |
9 |
11 |
|
D |
10 |
3 |
11099 |
◊ |
A |
x-1,y+1,z-1 |
1_464 |
11 |
5 |
11100 |
98.5 |
-1.9 |
0.364 |
1 |
0 |
0 |
0.000 |
10 |
12 |
|
[EDO]B:301 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
17 |
5 |
11173 |
89.2 |
2.2 |
0.305 |
3 |
0 |
0 |
0.000 |
11 |
13 |
|
D |
8 |
3 |
11099 |
x |
D |
x,y-1,z |
1_545 |
9 |
3 |
11099 |
62.6 |
-0.8 |
0.571 |
0 |
0 |
0 |
0.000 |
12 |
14 |
|
[CL]A:303 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
8 |
11173 |
54.2 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.063 |
13 |
15 |
|
B |
7 |
1 |
11173 |
x |
B |
x-1,y,z |
1_455 |
9 |
2 |
11173 |
54.2 |
-0.7 |
0.540 |
0 |
0 |
0 |
0.000 |
14 |
16 |
|
[MG]B:302 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
11173 |
51.1 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.150 |
17 |
|
[MG]A:301 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
11100 |
50.9 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.150 |
18 |
|
[MG]C:303 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
10 |
7 |
10974 |
47.8 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.150 |
19 |
|
[MG]D:301 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
9 |
6 |
11099 |
47.4 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.150 |
Average: |
49.3 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.150 |
15 |
20 |
|
[MG]D:302 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
8 |
6 |
11099 |
47.1 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.143 |
21 |
|
[MG]C:302 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
8 |
6 |
10974 |
46.9 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.143 |
22 |
|
[MG]B:303 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
6 |
11173 |
46.3 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.143 |
23 |
|
[MG]A:302 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
11100 |
45.8 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.143 |
Average: |
46.5 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.143 |
16 |
24 |
|
A |
5 |
2 |
11100 |
◊ |
B |
x,y-1,z |
1_545 |
3 |
3 |
11173 |
37.8 |
-0.8 |
0.296 |
0 |
0 |
0 |
0.000 |
17 |
25 |
|
D |
4 |
3 |
11099 |
◊ |
C |
x,y-1,z |
1_545 |
8 |
4 |
10974 |
34.6 |
-0.7 |
0.454 |
0 |
0 |
0 |
0.000 |
18 |
26 |
|
D |
2 |
1 |
11099 |
◊ |
B |
x,y,z-1 |
1_554 |
4 |
2 |
11173 |
32.5 |
-0.8 |
0.243 |
0 |
0 |
0 |
0.000 |
19 |
27 |
|
[CL]A:303 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
7 |
1 |
11100 |
30.7 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.034 |
20 |
28 |
|
[MG]D:302 |
1 |
1 |
98 |
f |
[MG]D:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
25.4 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.052 |
21 |
29 |
|
[MG]C:303 |
1 |
1 |
98 |
f |
[MG]C:302 |
x,y,z |
1_555 |
1 |
1 |
98 |
24.6 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.050 |
22 |
30 |
|
[MG]B:303 |
1 |
1 |
98 |
f |
[MG]B:302 |
x,y,z |
1_555 |
1 |
1 |
98 |
19.0 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.034 |
23 |
31 |
|
[MG]A:302 |
1 |
1 |
98 |
f |
[MG]A:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
17.5 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.032 |
24 |
32 |
|
C |
2 |
2 |
10974 |
◊ |
B |
x,y,z-1 |
1_554 |
5 |
2 |
11173 |
16.8 |
-0.3 |
0.434 |
0 |
0 |
0 |
0.000 |
25 |
33 |
|
C |
2 |
1 |
10974 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
11100 |
6.9 |
-0.0 |
0.603 |
0 |
0 |
0 |
0.000 |
26 |
34 |
|
A |
2 |
1 |
11100 |
◊ |
B |
x-1,y,z |
1_455 |
2 |
1 |
11173 |
0.8 |
-0.0 |
0.648 |
0 |
0 |
0 |
0.000 |
|