| ## |
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 |
105 |
30 |
42350 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
103 |
33 |
42432 |
1001.8 |
0.7 |
0.878 |
12 |
7 |
0 |
0.000 |
| 2 |
2 |
|
B |
73 |
19 |
42350 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
88 |
22 |
42432 |
651.0 |
-1.4 |
0.826 |
6 |
4 |
0 |
0.000 |
| 3 |
3 |
|
[CZA]A:1005 |
23 |
1 |
503 |
f |
A |
x,y,z |
1_555 |
55 |
20 |
42432 |
359.8 |
2.2 |
0.441 |
0 |
0 |
0 |
0.000 |
4 |
|
[CZA]B:1005 |
23 |
1 |
497 |
f |
B |
x,y,z |
1_555 |
49 |
21 |
42350 |
342.7 |
2.6 |
0.447 |
1 |
0 |
0 |
0.000 |
| Average: |
351.2 |
2.4 |
0.444 |
1 |
0 |
0 |
0.000 |
| 4 |
5 |
|
[ACP]A:1007 |
26 |
1 |
631 |
f |
A |
x,y,z |
1_555 |
52 |
21 |
42432 |
350.0 |
-0.2 |
0.700 |
3 |
0 |
0 |
0.001 |
| 5 |
6 |
|
[ACP]B:1007 |
26 |
1 |
644 |
f |
B |
x,y,z |
1_555 |
53 |
22 |
42350 |
335.8 |
-1.5 |
0.551 |
4 |
0 |
0 |
0.003 |
| 6 |
7 |
|
A |
28 |
9 |
42432 |
x |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
39 |
15 |
42432 |
307.0 |
1.4 |
0.880 |
6 |
6 |
0 |
0.000 |
| 7 |
8 |
|
B |
44 |
13 |
42350 |
◊ |
A |
x-1,y,z |
1_455 |
31 |
9 |
42432 |
297.7 |
-0.2 |
0.787 |
4 |
1 |
0 |
0.000 |
| 8 |
9 |
|
B |
37 |
11 |
42350 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
35 |
12 |
42432 |
282.7 |
-1.4 |
0.604 |
1 |
1 |
0 |
0.000 |
| 9 |
10 |
|
B |
30 |
11 |
42350 |
x |
B |
x-1/2,-y+1/2,-z |
4_455 |
29 |
12 |
42350 |
231.2 |
1.0 |
0.831 |
1 |
2 |
0 |
0.000 |
| 10 |
11 |
|
B |
28 |
8 |
42350 |
◊ |
A |
x,y,z |
1_555 |
23 |
6 |
42432 |
216.9 |
2.8 |
0.937 |
5 |
6 |
0 |
0.000 |
| 11 |
12 |
|
[K]B:1004 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
18 |
8 |
42350 |
131.7 |
-93.1 |
0.000 |
0 |
0 |
0 |
0.083 |
13 |
|
[K]A:1004 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
18 |
9 |
42432 |
125.9 |
-92.5 |
0.000 |
0 |
0 |
0 |
0.083 |
| Average: |
128.8 |
-92.8 |
0.000 |
0 |
0 |
0 |
0.083 |
| 12 |
14 |
|
[ACT]B:3002 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
23 |
10 |
42350 |
116.2 |
-0.7 |
0.628 |
1 |
0 |
0 |
0.001 |
| 13 |
15 |
|
[ACT]A:3002 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
21 |
9 |
42432 |
111.4 |
-0.7 |
0.625 |
1 |
0 |
0 |
0.000 |
| 14 |
16 |
|
[MF4]A:1003 |
5 |
1 |
227 |
f |
A |
x,y,z |
1_555 |
15 |
10 |
42432 |
105.4 |
3.7 |
0.677 |
8 |
0 |
0 |
0.000 |
17 |
|
[MF4]B:1003 |
5 |
1 |
227 |
f |
B |
x,y,z |
1_555 |
13 |
10 |
42350 |
103.9 |
3.8 |
0.602 |
8 |
0 |
0 |
0.000 |
| Average: |
104.7 |
3.7 |
0.639 |
8 |
0 |
0 |
0.000 |
| 15 |
18 |
|
[ACT]B:3001 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
42350 |
101.7 |
-0.7 |
0.597 |
3 |
0 |
0 |
0.002 |
| 16 |
19 |
|
[ACT]A:3001 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
42432 |
100.9 |
-0.6 |
0.644 |
2 |
0 |
0 |
0.001 |
| 17 |
20 |
|
[MN]B:1006 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
42350 |
63.1 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.003 |
21 |
|
[MN]A:1006 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
42432 |
59.3 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.003 |
| Average: |
61.2 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.003 |
| 18 |
22 |
|
A |
6 |
2 |
42432 |
x |
A |
x-1/2,-y+3/2,-z |
4_465 |
9 |
4 |
42432 |
62.7 |
-0.1 |
0.647 |
0 |
0 |
0 |
0.000 |
| 19 |
23 |
|
[ACP]A:1007 |
7 |
1 |
631 |
f |
[MN]A:1008 |
x,y,z |
1_555 |
1 |
1 |
123 |
52.4 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.004 |
| 20 |
24 |
|
[MN]A:1006 |
1 |
1 |
123 |
f |
[CZA]A:1005 |
x,y,z |
1_555 |
5 |
1 |
503 |
44.7 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.002 |
25 |
|
[MN]B:1006 |
1 |
1 |
123 |
f |
[CZA]B:1005 |
x,y,z |
1_555 |
5 |
1 |
497 |
42.6 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.002 |
| Average: |
43.6 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.002 |
| 21 |
26 |
|
[MG]A:1002 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
42432 |
40.6 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.006 |
27 |
|
[MG]B:1002 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
42350 |
40.5 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.006 |
| Average: |
40.6 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.006 |
| 22 |
28 |
|
[MN]A:1008 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
5 |
2 |
42432 |
35.3 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.001 |
| 23 |
29 |
|
[MF4]B:1003 |
1 |
1 |
227 |
f |
[MG]B:1002 |
x,y,z |
1_555 |
1 |
1 |
98 |
26.9 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.002 |
30 |
|
[MF4]A:1003 |
1 |
1 |
227 |
f |
[MG]A:1002 |
x,y,z |
1_555 |
1 |
1 |
98 |
26.6 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.002 |
| Average: |
26.8 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.002 |
| 24 |
31 |
|
B |
2 |
2 |
42350 |
x |
B |
-x,y-1/2,-z+1/2 |
3_545 |
3 |
2 |
42350 |
22.1 |
-0.3 |
0.464 |
0 |
0 |
0 |
0.000 |
| 25 |
32 |
|
B |
2 |
2 |
42350 |
◊ |
A |
x,y-1,z |
1_545 |
2 |
1 |
42432 |
2.6 |
-0.0 |
0.605 |
0 |
0 |
0 |
0.000 |
|