| ## |
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 |
378 |
77 |
11709 |
◊ |
A |
x,y,z |
1_555 |
358 |
79 |
11610 |
3411.1 |
-55.6 |
0.084 |
37 |
5 |
0 |
0.528 |
| 2 |
2 |
|
[ACO]A:1000 |
46 |
1 |
994 |
◊ |
A |
x,y,z |
1_555 |
84 |
26 |
11610 |
570.6 |
-2.5 |
0.636 |
19 |
0 |
0 |
0.294 |
| 3 |
3 |
|
[ACO]B:2000 |
46 |
1 |
996 |
f |
B |
x,y,z |
1_555 |
81 |
25 |
11709 |
553.5 |
-3.6 |
0.695 |
13 |
0 |
0 |
0.068 |
| 4 |
4 |
|
A |
41 |
12 |
11610 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
41 |
12 |
11610 |
400.3 |
-4.2 |
0.515 |
4 |
6 |
0 |
0.000 |
| 5 |
5 |
|
B |
42 |
13 |
11709 |
◊ |
B |
-x+1,y,-z |
2_655 |
41 |
13 |
11709 |
346.1 |
-3.9 |
0.546 |
1 |
2 |
0 |
0.000 |
| 6 |
6 |
|
A |
27 |
7 |
11610 |
◊ |
B |
x-1/2,y-1/2,z |
3_445 |
32 |
9 |
11709 |
271.9 |
-4.6 |
0.336 |
0 |
1 |
0 |
0.000 |
| 7 |
7 |
|
A |
26 |
10 |
11610 |
◊ |
B |
-x+1/2,y-1/2,-z+1 |
4_546 |
15 |
5 |
11709 |
209.4 |
-2.2 |
0.453 |
1 |
1 |
0 |
0.000 |
| 8 |
8 |
|
[ACO]B:2000 |
21 |
1 |
996 |
◊ |
[ACO]B:2000 |
-x+1,y,-z |
2_655 |
21 |
1 |
996 |
152.9 |
4.0 |
0.823 |
4 |
0 |
0 |
0.000 |
| 9 |
9 |
|
A |
17 |
6 |
11610 |
x |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
19 |
4 |
11610 |
152.5 |
-1.0 |
0.641 |
1 |
2 |
0 |
0.000 |
| 10 |
10 |
|
[ACO]B:2000 |
14 |
1 |
996 |
◊ |
B |
-x+1,y,-z |
2_655 |
21 |
8 |
11709 |
137.6 |
0.1 |
0.681 |
0 |
0 |
0 |
0.000 |
| 11 |
11 |
|
B |
11 |
3 |
11709 |
x |
B |
x-1/2,y-1/2,z |
3_445 |
12 |
4 |
11709 |
98.4 |
-0.1 |
0.688 |
0 |
0 |
0 |
0.000 |
| 12 |
12 |
|
[ACT]A:801 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
11610 |
88.2 |
-0.3 |
0.680 |
2 |
0 |
0 |
0.032 |
| 13 |
13 |
|
[ACO]A:1000 |
7 |
1 |
994 |
cf |
[ACO]A:1000 |
-x,y,-z+1 |
2_556 |
7 |
1 |
994 |
64.9 |
2.4 |
0.734 |
0 |
0 |
0 |
0.000 |
| 14 |
14 |
|
A |
6 |
3 |
11610 |
◊ |
A |
-x,y,-z+1 |
2_556 |
6 |
3 |
11610 |
63.8 |
-1.1 |
0.375 |
0 |
0 |
0 |
0.015 |
| 15 |
15 |
|
B |
7 |
4 |
11709 |
◊ |
A |
x-1/2,y+1/2,z |
3_455 |
6 |
4 |
11610 |
58.0 |
0.7 |
0.814 |
1 |
0 |
0 |
0.000 |
| 16 |
16 |
|
[ACO]A:1000 |
6 |
1 |
994 |
◊ |
[ACT]A:801 |
x,y,z |
1_555 |
4 |
1 |
182 |
42.0 |
-0.8 |
0.513 |
0 |
0 |
0 |
0.023 |
| 17 |
17 |
|
[CA]A:305 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
11610 |
41.5 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.224 |
| 18 |
18 |
|
[CA]B:302 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
6 |
4 |
11709 |
40.4 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.213 |
19 |
|
[CA]A:301 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
11610 |
39.6 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.213 |
| Average: |
40.0 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.213 |
| 19 |
20 |
|
[CA]B:304 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
11709 |
38.0 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.207 |
21 |
|
[CA]A:303 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
11610 |
34.6 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.207 |
| Average: |
36.3 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.207 |
| 20 |
22 |
|
[ACT]A:801 |
4 |
1 |
182 |
◊ |
B |
x,y,z |
1_555 |
10 |
1 |
11709 |
28.7 |
-0.3 |
0.678 |
0 |
0 |
0 |
0.002 |
| 21 |
23 |
|
[CA]A:301 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
11709 |
24.9 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.055 |
24 |
|
[CA]B:302 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
11610 |
19.8 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.055 |
| Average: |
22.3 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.055 |
| 22 |
25 |
|
B |
4 |
2 |
11709 |
x |
B |
x-1/2,y+1/2,z |
3_455 |
5 |
2 |
11709 |
20.7 |
0.1 |
0.708 |
0 |
0 |
0 |
0.000 |
| 23 |
26 |
|
[CA]A:303 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
11709 |
17.3 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.035 |
27 |
|
[CA]B:304 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
11610 |
10.6 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.035 |
| Average: |
14.0 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.035 |
| 24 |
28 |
|
[ACO]B:2000 |
2 |
1 |
996 |
f |
[CA]B:302 |
x,y,z |
1_555 |
1 |
1 |
85 |
9.7 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.011 |
| 25 |
29 |
|
[CA]A:305 |
1 |
1 |
85 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
3 |
1 |
11610 |
9.3 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.000 |
| 26 |
30 |
|
[ACO]A:1000 |
1 |
1 |
994 |
◊ |
[CA]A:301 |
x,y,z |
1_555 |
1 |
1 |
85 |
5.7 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.024 |
| 27 |
31 |
|
B |
1 |
1 |
11709 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
1 |
1 |
11610 |
0.4 |
0.0 |
0.666 |
0 |
0 |
0 |
0.000 |
|