## |
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 |
|
[5CM]A:5 |
19 |
1 |
450 |
cf |
A |
x,y,z |
1_555 |
29 |
2 |
1358 |
214.2 |
5.0 |
0.654 |
0 |
0 |
0 |
0.000 |
2 |
2 |
|
[5CM]B:11 |
20 |
1 |
452 |
cf |
B |
x,y,z |
1_555 |
32 |
2 |
1366 |
184.2 |
3.9 |
0.633 |
0 |
0 |
0 |
0.000 |
3 |
3 |
|
B |
16 |
3 |
1366 |
◊ |
A |
x,y,z |
1_555 |
16 |
4 |
1358 |
126.5 |
-3.0 |
0.446 |
4 |
0 |
0 |
0.210 |
4 |
4 |
|
[5CM]B:7 |
14 |
1 |
403 |
cf |
B |
x,y,z |
1_555 |
17 |
1 |
1366 |
97.7 |
1.7 |
0.272 |
0 |
0 |
0 |
0.000 |
5 |
|
[5CM]A:1 |
13 |
1 |
400 |
cf |
A |
x,y,z |
1_555 |
15 |
1 |
1358 |
88.1 |
1.5 |
0.257 |
0 |
0 |
0 |
0.000 |
Average: |
92.9 |
1.6 |
0.265 |
0 |
0 |
0 |
0.000 |
5 |
6 |
|
B |
16 |
1 |
1366 |
◊ |
[5CM]B:7 |
-x+3/2,-y+1,z-1/2 |
2_664 |
12 |
1 |
403 |
86.6 |
3.7 |
0.407 |
0 |
0 |
0 |
0.000 |
6 |
7 |
|
A |
8 |
1 |
1358 |
◊ |
B |
-x+1,y-1/2,-z+3/2 |
3_646 |
11 |
2 |
1366 |
83.6 |
0.5 |
0.611 |
0 |
0 |
0 |
0.000 |
7 |
8 |
|
[5CM]A:1 |
11 |
1 |
400 |
◊ |
A |
-x+3/2,-y+1,z-1/2 |
2_664 |
15 |
1 |
1358 |
81.5 |
3.2 |
0.370 |
0 |
0 |
0 |
0.000 |
8 |
9 |
|
A |
8 |
3 |
1358 |
◊ |
B |
-x+2,y-1/2,-z+3/2 |
3_746 |
9 |
1 |
1366 |
76.4 |
1.2 |
0.633 |
0 |
0 |
0 |
0.000 |
9 |
10 |
|
B |
9 |
1 |
1366 |
◊ |
A |
x-1,y,z |
1_455 |
8 |
1 |
1358 |
74.6 |
-1.2 |
0.461 |
0 |
0 |
0 |
0.006 |
10 |
11 |
|
[CUL]B:14 |
3 |
1 |
239 |
◊ |
B |
x-1/2,-y+3/2,-z+1 |
4_466 |
12 |
3 |
1366 |
60.0 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.000 |
11 |
12 |
|
[5CM]B:7 |
11 |
1 |
403 |
◊ |
[5CM]A:5 |
x,y,z |
1_555 |
11 |
1 |
450 |
59.7 |
2.2 |
0.243 |
0 |
0 |
0 |
0.000 |
13 |
|
[5CM]B:11 |
11 |
1 |
452 |
◊ |
[5CM]A:1 |
x,y,z |
1_555 |
11 |
1 |
400 |
56.4 |
2.1 |
0.241 |
0 |
0 |
0 |
0.000 |
Average: |
58.0 |
2.2 |
0.242 |
0 |
0 |
0 |
0.000 |
12 |
14 |
|
[CUL]B:14 |
3 |
1 |
239 |
f |
B |
x,y,z |
1_555 |
7 |
2 |
1366 |
59.5 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.210 |
13 |
15 |
|
[5CM]A:5 |
6 |
1 |
450 |
◊ |
B |
x,y,z |
1_555 |
9 |
2 |
1366 |
58.2 |
-0.7 |
0.399 |
3 |
0 |
0 |
0.172 |
16 |
|
[5CM]B:11 |
5 |
1 |
452 |
◊ |
A |
x,y,z |
1_555 |
8 |
2 |
1358 |
52.1 |
-0.6 |
0.417 |
3 |
0 |
0 |
0.172 |
Average: |
55.1 |
-0.6 |
0.408 |
3 |
0 |
0 |
0.172 |
14 |
17 |
|
[5CM]A:5 |
4 |
1 |
450 |
◊ |
B |
-x+2,y-1/2,-z+3/2 |
3_746 |
8 |
2 |
1366 |
55.2 |
1.5 |
0.555 |
0 |
0 |
0 |
0.000 |
15 |
18 |
|
[5CM]B:7 |
4 |
1 |
403 |
◊ |
A |
x,y,z |
1_555 |
5 |
1 |
1358 |
44.3 |
-0.4 |
0.307 |
3 |
0 |
0 |
0.074 |
16 |
19 |
|
[5CM]A:1 |
4 |
1 |
400 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
1366 |
43.2 |
-0.3 |
0.302 |
3 |
0 |
0 |
0.073 |
17 |
20 |
|
[CU]B:13 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
1366 |
40.7 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.408 |
21 |
|
[CU]A:7 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
1358 |
37.7 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.408 |
Average: |
39.2 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.408 |
18 |
22 |
|
B |
6 |
1 |
1366 |
◊ |
[5CM]A:1 |
x-1,y,z |
1_455 |
5 |
1 |
400 |
37.6 |
1.0 |
0.444 |
0 |
0 |
0 |
0.000 |
19 |
23 |
|
[CU]A:8 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
4 |
1 |
1358 |
35.9 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.179 |
20 |
24 |
|
[5CM]B:11 |
6 |
1 |
452 |
◊ |
A |
x-1,y,z |
1_455 |
3 |
1 |
1358 |
33.8 |
0.8 |
0.457 |
0 |
0 |
0 |
0.000 |
21 |
25 |
|
[CUL]B:14 |
2 |
1 |
239 |
f |
[5CM]B:11 |
x,y,z |
1_555 |
7 |
1 |
452 |
31.9 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.156 |
22 |
26 |
|
A |
5 |
1 |
1358 |
◊ |
[5CM]B:7 |
-x+2,y-1/2,-z+3/2 |
3_746 |
4 |
1 |
403 |
31.6 |
1.2 |
0.443 |
0 |
0 |
0 |
0.000 |
23 |
27 |
|
B |
6 |
1 |
1366 |
◊ |
[5CM]A:1 |
x-1/2,-y+3/2,-z+1 |
4_466 |
2 |
1 |
400 |
29.2 |
1.2 |
0.682 |
0 |
0 |
0 |
0.000 |
24 |
28 |
|
B |
5 |
1 |
1366 |
◊ |
A |
-x+3/2,-y+1,z-1/2 |
2_664 |
5 |
1 |
1358 |
29.0 |
-0.6 |
0.475 |
0 |
0 |
0 |
0.000 |
25 |
29 |
|
[CUL]B:14 |
2 |
1 |
239 |
◊ |
[5CM]B:11 |
x-1/2,-y+3/2,-z+1 |
4_466 |
3 |
1 |
452 |
26.1 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.000 |
26 |
30 |
|
[5CM]B:11 |
4 |
1 |
452 |
◊ |
[CU]A:7 |
x-1,y,z |
1_455 |
1 |
1 |
125 |
24.7 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.018 |
27 |
31 |
|
B |
3 |
1 |
1366 |
x |
B |
x-1/2,-y+3/2,-z+1 |
4_466 |
3 |
1 |
1366 |
23.9 |
0.8 |
0.616 |
0 |
0 |
0 |
0.000 |
28 |
32 |
|
[5CM]A:1 |
6 |
1 |
400 |
◊ |
[5CM]B:7 |
-x+3/2,-y+1,z-1/2 |
2_664 |
6 |
1 |
403 |
21.9 |
0.6 |
0.161 |
0 |
0 |
0 |
0.000 |
29 |
33 |
|
B |
2 |
1 |
1366 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
2 |
1 |
1358 |
21.8 |
0.5 |
0.516 |
0 |
0 |
0 |
0.000 |
30 |
34 |
|
[CUL]B:14 |
2 |
1 |
239 |
◊ |
[5CM]B:7 |
-x+3/2,-y+1,z-1/2 |
2_664 |
2 |
1 |
403 |
21.8 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.000 |
31 |
35 |
|
[CU]A:8 |
1 |
1 |
125 |
f |
[5CM]A:5 |
x,y,z |
1_555 |
6 |
1 |
450 |
21.6 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.197 |
36 |
|
[CU]B:13 |
1 |
1 |
125 |
f |
[5CM]B:7 |
x,y,z |
1_555 |
2 |
1 |
403 |
12.0 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.197 |
37 |
|
[CU]A:7 |
1 |
1 |
125 |
f |
[5CM]A:1 |
x,y,z |
1_555 |
1 |
1 |
400 |
6.0 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.197 |
Average: |
13.2 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.197 |
32 |
38 |
|
[CU]A:8 |
1 |
1 |
125 |
◊ |
B |
-x+2,y-1/2,-z+3/2 |
3_746 |
4 |
2 |
1366 |
20.6 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.000 |
33 |
39 |
|
[5CM]A:5 |
3 |
1 |
450 |
◊ |
B |
-x+1,y-1/2,-z+3/2 |
3_646 |
1 |
1 |
1366 |
17.4 |
-1.2 |
0.203 |
0 |
0 |
0 |
0.000 |
34 |
40 |
|
[CU]A:8 |
1 |
1 |
125 |
◊ |
B |
-x+1,y-1/2,-z+3/2 |
3_646 |
7 |
1 |
1366 |
17.0 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.000 |
35 |
41 |
|
B |
3 |
1 |
1366 |
◊ |
[CU]B:13 |
x-1,y,z |
1_455 |
1 |
1 |
125 |
16.8 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.000 |
36 |
42 |
|
[5CM]B:11 |
2 |
1 |
452 |
◊ |
[5CM]A:1 |
x-1/2,-y+3/2,-z+1 |
4_466 |
2 |
1 |
400 |
15.7 |
0.4 |
0.401 |
0 |
0 |
0 |
0.000 |
37 |
43 |
|
[CUL]B:14 |
2 |
1 |
239 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
1 |
1 |
1358 |
14.9 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
38 |
44 |
|
[5CM]B:11 |
2 |
1 |
452 |
x |
[5CM]B:11 |
x-1/2,-y+3/2,-z+1 |
4_466 |
2 |
1 |
452 |
14.2 |
-0.5 |
0.281 |
0 |
0 |
0 |
0.000 |
39 |
45 |
|
[5CM]B:11 |
1 |
1 |
452 |
◊ |
[CU]A:7 |
x-1/2,-y+3/2,-z+1 |
4_466 |
1 |
1 |
125 |
14.1 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.000 |
40 |
46 |
|
[5CM]A:5 |
3 |
1 |
450 |
◊ |
[CU]B:13 |
-x+2,y-1/2,-z+3/2 |
3_746 |
1 |
1 |
125 |
13.9 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.000 |
41 |
47 |
|
[CUL]B:14 |
1 |
1 |
239 |
◊ |
[5CM]A:1 |
x-1/2,-y+3/2,-z+1 |
4_466 |
4 |
1 |
400 |
13.6 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.000 |
42 |
48 |
|
[5CM]B:7 |
2 |
1 |
403 |
◊ |
B |
-x+2,y-1/2,-z+3/2 |
3_746 |
4 |
2 |
1366 |
13.5 |
-0.0 |
0.371 |
0 |
0 |
0 |
0.000 |
43 |
49 |
|
A |
4 |
1 |
1358 |
◊ |
[5CM]B:7 |
x-1,y,z |
1_455 |
1 |
1 |
403 |
12.8 |
0.5 |
0.630 |
0 |
0 |
0 |
0.000 |
44 |
50 |
|
[5CM]A:1 |
3 |
1 |
400 |
◊ |
[CU]A:8 |
-x+3/2,-y+1,z-1/2 |
2_664 |
1 |
1 |
125 |
12.6 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.000 |
45 |
51 |
|
[5CM]A:5 |
2 |
1 |
450 |
◊ |
[5CM]B:7 |
-x+2,y-1/2,-z+3/2 |
3_746 |
2 |
1 |
403 |
11.1 |
0.1 |
0.262 |
0 |
0 |
0 |
0.000 |
46 |
52 |
|
[CUL]B:14 |
2 |
1 |
239 |
◊ |
A |
x-1/2,-y+3/2,-z+1 |
4_466 |
1 |
1 |
1358 |
10.2 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
47 |
53 |
|
A |
1 |
1 |
1358 |
◊ |
[CU]B:13 |
x-1,y,z |
1_455 |
1 |
1 |
125 |
9.7 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
48 |
54 |
|
B |
1 |
1 |
1366 |
◊ |
[CU]A:7 |
x-1,y,z |
1_455 |
1 |
1 |
125 |
9.6 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.006 |
49 |
55 |
|
[CUL]B:14 |
1 |
1 |
239 |
◊ |
[5CM]A:5 |
-x+3/2,-y+1,z-1/2 |
2_664 |
1 |
1 |
450 |
9.1 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
50 |
56 |
|
[5CM]A:1 |
2 |
1 |
400 |
◊ |
[CU]A:7 |
x-1/2,-y+3/2,-z+1 |
4_466 |
1 |
1 |
125 |
8.8 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.000 |
51 |
57 |
|
[CU]A:7 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
1366 |
8.7 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.035 |
58 |
|
[CU]B:13 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
1358 |
2.3 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.035 |
Average: |
5.5 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.035 |
52 |
59 |
|
[CUL]B:14 |
1 |
1 |
239 |
◊ |
[CU]A:7 |
x-1,y,z |
1_455 |
1 |
1 |
125 |
8.0 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.008 |
53 |
60 |
|
[CU]A:8 |
1 |
1 |
125 |
◊ |
[CU]B:13 |
-x+2,y-1/2,-z+3/2 |
3_746 |
1 |
1 |
125 |
7.8 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.000 |
54 |
61 |
|
[CUL]B:14 |
1 |
1 |
239 |
◊ |
A |
-x+3/2,-y+1,z-1/2 |
2_664 |
1 |
1 |
1358 |
7.6 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.000 |
55 |
62 |
|
[5CM]B:11 |
1 |
1 |
452 |
◊ |
[5CM]A:1 |
x-1,y,z |
1_455 |
1 |
1 |
400 |
6.2 |
0.4 |
0.553 |
0 |
0 |
0 |
0.000 |
56 |
63 |
|
B |
2 |
1 |
1366 |
◊ |
[5CM]B:11 |
x-1/2,-y+3/2,-z+1 |
4_466 |
2 |
1 |
452 |
4.7 |
-0.0 |
0.342 |
0 |
0 |
0 |
0.000 |
57 |
64 |
|
[CU]A:8 |
1 |
1 |
125 |
◊ |
[CU]A:7 |
-x+2,y-1/2,-z+3/2 |
3_746 |
1 |
1 |
125 |
4.4 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.000 |
58 |
65 |
|
[5CM]B:11 |
1 |
1 |
452 |
◊ |
B |
x-1/2,-y+3/2,-z+1 |
4_466 |
2 |
1 |
1366 |
3.5 |
-0.1 |
0.260 |
0 |
0 |
0 |
0.000 |
59 |
66 |
|
A |
1 |
1 |
1358 |
◊ |
[CU]B:13 |
-x+2,y-1/2,-z+3/2 |
3_746 |
1 |
1 |
125 |
2.2 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.000 |
60 |
67 |
|
A |
1 |
1 |
1358 |
◊ |
[5CM]B:11 |
-x+1,y-1/2,-z+3/2 |
3_646 |
1 |
1 |
452 |
2.1 |
0.1 |
0.413 |
0 |
0 |
0 |
0.000 |
61 |
68 |
|
[5CM]B:11 |
1 |
1 |
452 |
◊ |
A |
x-1/2,-y+3/2,-z+1 |
4_466 |
1 |
1 |
1358 |
0.8 |
-0.0 |
0.311 |
0 |
0 |
0 |
0.000 |
62 |
69 |
|
[CU]A:8 |
1 |
1 |
125 |
◊ |
[5CM]B:11 |
-x+1,y-1/2,-z+3/2 |
3_646 |
1 |
1 |
452 |
0.8 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
63 |
70 |
|
[CU]A:8 |
1 |
1 |
125 |
◊ |
[5CM]B:7 |
x,y,z |
1_555 |
1 |
1 |
403 |
0.6 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.004 |
71 |
|
[CU]A:7 |
1 |
1 |
125 |
◊ |
[5CM]B:11 |
x,y,z |
1_555 |
1 |
1 |
452 |
0.5 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.004 |
Average: |
0.5 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.004 |
64 |
72 |
|
B |
1 |
1 |
1366 |
◊ |
[CU]A:8 |
-x+3/2,-y+1,z-1/2 |
2_664 |
1 |
1 |
125 |
0.2 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.000 |
65 |
73 |
|
[CUL]B:14 |
1 |
1 |
239 |
◊ |
[CU]A:8 |
-x+3/2,-y+1,z-1/2 |
2_664 |
1 |
1 |
125 |
0.1 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.000 |
|