## |
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 |
80 |
24 |
14654 |
◊ |
A |
x,y,z-1 |
1_554 |
94 |
28 |
14753 |
822.8 |
-2.4 |
0.564 |
13 |
10 |
0 |
0.000 |
2 |
|
B |
89 |
29 |
14654 |
◊ |
A |
x,y,z |
1_555 |
76 |
23 |
14753 |
782.3 |
-2.2 |
0.585 |
9 |
7 |
0 |
0.000 |
Average: |
802.5 |
-2.3 |
0.574 |
11 |
9 |
0 |
0.000 |
2 |
3 |
|
B |
66 |
19 |
14654 |
x |
B |
x-1,y,z |
1_455 |
59 |
17 |
14654 |
602.2 |
-1.5 |
0.593 |
5 |
6 |
0 |
0.000 |
4 |
|
A |
57 |
18 |
14753 |
x |
A |
x-1,y,z |
1_455 |
64 |
19 |
14753 |
585.1 |
-1.0 |
0.581 |
5 |
4 |
0 |
0.000 |
Average: |
593.6 |
-1.2 |
0.587 |
5 |
5 |
0 |
0.000 |
3 |
5 |
|
A |
59 |
19 |
14753 |
x |
A |
x,y-1,z |
1_545 |
50 |
15 |
14753 |
473.7 |
-7.1 |
0.138 |
1 |
0 |
0 |
0.000 |
6 |
|
B |
40 |
13 |
14654 |
x |
B |
x,y-1,z |
1_545 |
43 |
14 |
14654 |
331.0 |
-1.9 |
0.488 |
1 |
0 |
0 |
0.000 |
Average: |
402.4 |
-4.5 |
0.313 |
1 |
0 |
0 |
0.000 |
4 |
7 |
|
[F3W]B:1201 |
26 |
1 |
591 |
f |
B |
x,y,z |
1_555 |
48 |
18 |
14654 |
403.9 |
2.5 |
0.417 |
1 |
0 |
0 |
0.000 |
8 |
|
[F3W]A:1201 |
26 |
1 |
588 |
f |
A |
x,y,z |
1_555 |
50 |
19 |
14753 |
401.3 |
2.7 |
0.440 |
1 |
0 |
0 |
0.000 |
Average: |
402.6 |
2.6 |
0.429 |
1 |
0 |
0 |
0.000 |
5 |
9 |
|
B |
43 |
15 |
14654 |
◊ |
A |
x-1,y,z-1 |
1_454 |
36 |
14 |
14753 |
342.3 |
0.1 |
0.624 |
3 |
4 |
0 |
0.000 |
10 |
|
B |
31 |
12 |
14654 |
◊ |
A |
x-1,y,z |
1_455 |
46 |
14 |
14753 |
315.8 |
0.0 |
0.646 |
3 |
4 |
0 |
0.000 |
Average: |
329.0 |
0.1 |
0.635 |
3 |
4 |
0 |
0.000 |
6 |
11 |
|
[PHU]A:1202 |
10 |
1 |
295 |
f |
A |
x,y,z |
1_555 |
33 |
13 |
14753 |
200.1 |
5.9 |
0.410 |
1 |
0 |
0 |
0.000 |
7 |
12 |
|
[PHU]B:1202 |
10 |
1 |
295 |
f |
B |
x,y,z |
1_555 |
33 |
13 |
14654 |
199.0 |
5.9 |
0.426 |
1 |
0 |
0 |
0.000 |
8 |
13 |
|
A |
16 |
5 |
14753 |
◊ |
B |
x,y-1,z |
1_545 |
19 |
5 |
14654 |
148.4 |
0.6 |
0.701 |
1 |
0 |
0 |
0.000 |
9 |
14 |
|
[EDO]B:1208 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
20 |
9 |
14654 |
121.0 |
3.9 |
0.655 |
3 |
0 |
0 |
0.000 |
10 |
15 |
|
[GOL]B:1203 |
6 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
20 |
9 |
14654 |
120.2 |
-0.3 |
0.597 |
4 |
0 |
0 |
0.000 |
16 |
|
[GOL]A:1203 |
6 |
1 |
215 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
14753 |
120.0 |
-0.3 |
0.562 |
4 |
0 |
0 |
0.000 |
Average: |
120.1 |
-0.3 |
0.579 |
4 |
0 |
0 |
0.000 |
11 |
17 |
|
[EDO]A:1209 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
20 |
9 |
14753 |
118.7 |
3.8 |
0.654 |
3 |
0 |
0 |
0.000 |
12 |
18 |
|
[EDO]B:1205 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
22 |
9 |
14654 |
115.8 |
3.4 |
0.455 |
0 |
0 |
0 |
0.000 |
13 |
19 |
|
[EDO]A:1206 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
21 |
9 |
14753 |
113.6 |
3.1 |
0.435 |
0 |
0 |
0 |
0.000 |
14 |
20 |
|
A |
18 |
6 |
14753 |
◊ |
[EDO]A:1210 |
x-1,y,z |
1_455 |
4 |
1 |
185 |
108.6 |
2.9 |
0.446 |
2 |
0 |
0 |
0.000 |
15 |
21 |
|
[EDO]B:1207 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
17 |
8 |
14654 |
106.5 |
3.8 |
0.533 |
2 |
0 |
0 |
0.000 |
16 |
22 |
|
[EDO]A:1208 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
14753 |
106.3 |
3.9 |
0.530 |
2 |
0 |
0 |
0.000 |
17 |
23 |
|
A |
13 |
3 |
14753 |
◊ |
B |
x,y-1,z+1 |
1_546 |
10 |
2 |
14654 |
97.4 |
-1.5 |
0.315 |
0 |
0 |
0 |
0.000 |
18 |
24 |
|
[EDO]B:1206 |
4 |
1 |
186 |
◊ |
B |
x-1,y,z |
1_455 |
15 |
5 |
14654 |
88.9 |
2.4 |
0.276 |
2 |
0 |
0 |
0.000 |
19 |
25 |
|
[EDO]A:1207 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
15 |
5 |
14753 |
87.8 |
2.8 |
0.288 |
1 |
0 |
0 |
0.000 |
20 |
26 |
|
[EDO]B:1204 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
12 |
5 |
14654 |
84.7 |
2.5 |
0.297 |
3 |
0 |
0 |
0.000 |
21 |
27 |
|
B |
12 |
5 |
14654 |
◊ |
[EDO]A:1205 |
x-1,y,z |
1_455 |
4 |
1 |
185 |
80.9 |
3.0 |
0.493 |
0 |
0 |
0 |
0.000 |
22 |
28 |
|
[EDO]A:1204 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
13 |
5 |
14753 |
79.8 |
2.8 |
0.500 |
2 |
0 |
0 |
0.000 |
23 |
29 |
|
B |
8 |
4 |
14654 |
x |
B |
x-1,y-1,z |
1_445 |
11 |
5 |
14654 |
73.2 |
0.3 |
0.687 |
1 |
0 |
0 |
0.000 |
30 |
|
A |
7 |
5 |
14753 |
x |
A |
x-1,y-1,z |
1_445 |
6 |
2 |
14753 |
40.5 |
0.8 |
0.769 |
0 |
0 |
0 |
0.000 |
Average: |
56.9 |
0.5 |
0.728 |
1 |
0 |
0 |
0.000 |
24 |
31 |
|
[EDO]B:1209 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
8 |
5 |
14654 |
72.8 |
1.6 |
0.230 |
2 |
0 |
0 |
0.000 |
25 |
32 |
|
[EDO]A:1205 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
7 |
2 |
14753 |
62.9 |
1.7 |
0.905 |
3 |
0 |
0 |
0.000 |
26 |
33 |
|
[EDO]B:1206 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
14654 |
59.9 |
1.3 |
0.716 |
0 |
0 |
0 |
0.000 |
27 |
34 |
|
[EDO]A:1207 |
3 |
1 |
183 |
f |
A |
x-1,y,z |
1_455 |
7 |
3 |
14753 |
57.9 |
1.8 |
0.267 |
0 |
0 |
0 |
0.000 |
28 |
35 |
|
[EDO]B:1209 |
2 |
1 |
185 |
f |
A |
x,y,z-1 |
1_554 |
5 |
2 |
14753 |
46.0 |
0.6 |
0.377 |
0 |
0 |
0 |
0.000 |
29 |
36 |
|
A |
3 |
1 |
14753 |
◊ |
[EDO]A:1204 |
x-1,y,z |
1_455 |
3 |
1 |
184 |
44.6 |
1.0 |
0.803 |
1 |
0 |
0 |
0.000 |
30 |
37 |
|
[EDO]A:1210 |
3 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
14753 |
42.7 |
0.9 |
0.844 |
2 |
0 |
0 |
0.000 |
31 |
38 |
|
[EDO]B:1204 |
2 |
1 |
184 |
◊ |
A |
x-1,y,z-1 |
1_454 |
5 |
2 |
14753 |
39.9 |
0.6 |
0.283 |
0 |
0 |
0 |
0.000 |
32 |
39 |
|
B |
4 |
2 |
14654 |
f |
[EDO]A:1204 |
x-1,y,z |
1_455 |
3 |
1 |
184 |
38.4 |
0.2 |
0.335 |
0 |
0 |
0 |
0.000 |
33 |
40 |
|
[EDO]B:1204 |
3 |
1 |
184 |
f |
B |
x-1,y,z |
1_455 |
4 |
2 |
14654 |
37.1 |
0.4 |
0.534 |
0 |
0 |
0 |
0.000 |
34 |
41 |
|
[EDO]B:1205 |
2 |
1 |
185 |
f |
[F3W]B:1201 |
x,y,z |
1_555 |
2 |
1 |
591 |
28.2 |
1.3 |
0.810 |
0 |
0 |
0 |
0.000 |
35 |
42 |
|
[EDO]A:1206 |
2 |
1 |
183 |
f |
[F3W]A:1201 |
x,y,z |
1_555 |
2 |
1 |
588 |
24.9 |
0.8 |
0.783 |
0 |
0 |
0 |
0.000 |
|