## |
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 |
139 |
35 |
9645 |
◊ |
A |
x,y,z |
1_555 |
134 |
31 |
9486 |
1329.1 |
-9.5 |
0.467 |
22 |
6 |
0 |
1.000 |
2 |
2 |
|
B |
49 |
18 |
9645 |
x |
B |
-x+1/2,y-1/2,-z |
4_545 |
45 |
16 |
9645 |
435.0 |
-3.0 |
0.478 |
2 |
0 |
0 |
0.000 |
3 |
3 |
|
A |
47 |
15 |
9486 |
x |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
41 |
14 |
9486 |
363.3 |
-2.7 |
0.553 |
1 |
1 |
0 |
0.000 |
4 |
4 |
|
A |
32 |
7 |
9486 |
◊ |
A |
-x,y,-z+1 |
2_556 |
31 |
7 |
9486 |
292.4 |
1.9 |
0.881 |
0 |
0 |
0 |
0.000 |
5 |
5 |
|
B |
30 |
8 |
9645 |
◊ |
B |
-x+1,y,-z |
2_655 |
30 |
8 |
9645 |
276.7 |
-0.1 |
0.700 |
2 |
0 |
0 |
0.000 |
6 |
6 |
|
A |
26 |
8 |
9486 |
◊ |
B |
x-1/2,y-1/2,z |
3_445 |
16 |
7 |
9645 |
172.0 |
-2.1 |
0.180 |
0 |
0 |
0 |
0.000 |
7 |
7 |
|
[EDO]A:204 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
20 |
8 |
9486 |
119.2 |
3.4 |
0.484 |
3 |
0 |
0 |
0.000 |
8 |
8 |
|
A |
12 |
3 |
9486 |
x |
A |
x-1/2,y-1/2,z |
3_445 |
14 |
3 |
9486 |
113.8 |
-1.1 |
0.479 |
0 |
0 |
0 |
0.000 |
9 |
9 |
|
B |
13 |
5 |
9645 |
◊ |
A |
-x,y,-z |
2_555 |
8 |
5 |
9486 |
109.0 |
0.3 |
0.659 |
0 |
0 |
0 |
0.000 |
10 |
10 |
|
[EDO]A:206 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
16 |
6 |
9486 |
106.2 |
3.2 |
0.479 |
1 |
0 |
0 |
0.000 |
11 |
11 |
|
[EDO]B:203 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
15 |
7 |
9645 |
103.9 |
2.4 |
0.434 |
3 |
0 |
0 |
0.000 |
12 |
12 |
|
[EDO]B:202 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
18 |
9 |
9645 |
100.1 |
2.6 |
0.481 |
4 |
0 |
0 |
0.000 |
13 |
13 |
|
[EDO]A:207 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
15 |
8 |
9486 |
99.0 |
2.8 |
0.481 |
4 |
0 |
0 |
0.000 |
14 |
14 |
|
[EDO]A:205 |
4 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
9486 |
93.3 |
2.5 |
0.303 |
4 |
0 |
0 |
0.000 |
15 |
15 |
|
[IOD]B:199 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
14 |
8 |
9645 |
79.7 |
-0.2 |
0.730 |
0 |
0 |
0 |
0.012 |
16 |
16 |
|
[IOD]B:201 |
1 |
1 |
144 |
◊ |
B |
x,y,z |
1_555 |
13 |
4 |
9645 |
74.5 |
0.6 |
0.881 |
0 |
0 |
0 |
0.000 |
17 |
|
[IOD]A:200 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
9486 |
56.7 |
0.1 |
0.822 |
0 |
0 |
0 |
0.000 |
Average: |
65.6 |
0.4 |
0.852 |
0 |
0 |
0 |
0.000 |
17 |
18 |
|
[IOD]A:198 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
9 |
3 |
9486 |
66.9 |
1.1 |
0.954 |
0 |
0 |
0 |
0.000 |
19 |
|
[IOD]B:200 |
1 |
1 |
144 |
◊ |
B |
x,y,z |
1_555 |
7 |
2 |
9645 |
46.3 |
0.4 |
0.876 |
0 |
0 |
0 |
0.000 |
Average: |
56.6 |
0.7 |
0.915 |
0 |
0 |
0 |
0.000 |
18 |
20 |
|
A |
10 |
4 |
9486 |
f |
[IOD]A:202 |
-x+1/2,y-1/2,-z+1 |
4_546 |
1 |
1 |
144 |
66.9 |
-0.3 |
0.681 |
0 |
0 |
0 |
0.294 |
19 |
21 |
|
[IOD]A:203 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
13 |
7 |
9486 |
63.7 |
-0.1 |
0.770 |
0 |
0 |
0 |
0.000 |
20 |
22 |
|
[IOD]B:200 |
1 |
1 |
144 |
f |
B |
-x+1,y,-z |
2_655 |
8 |
3 |
9645 |
62.8 |
-0.2 |
0.665 |
0 |
0 |
0 |
0.165 |
23 |
|
[IOD]A:198 |
1 |
1 |
144 |
f |
A |
-x,y,-z+1 |
2_556 |
8 |
4 |
9486 |
59.1 |
-0.2 |
0.687 |
0 |
0 |
0 |
0.165 |
Average: |
60.9 |
-0.2 |
0.676 |
0 |
0 |
0 |
0.165 |
21 |
24 |
|
[IOD]A:199 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
10 |
6 |
9486 |
61.2 |
-0.2 |
0.700 |
0 |
0 |
0 |
0.011 |
22 |
25 |
|
[IOD]A:201 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
12 |
6 |
9486 |
58.3 |
-0.2 |
0.743 |
0 |
0 |
0 |
0.020 |
26 |
|
[IOD]B:198 |
1 |
1 |
144 |
◊ |
B |
x,y,z |
1_555 |
12 |
6 |
9645 |
56.4 |
-0.2 |
0.725 |
0 |
0 |
0 |
0.020 |
Average: |
57.4 |
-0.2 |
0.734 |
0 |
0 |
0 |
0.020 |
23 |
27 |
|
[IOD]A:199 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
9 |
2 |
9645 |
52.2 |
-0.5 |
0.595 |
0 |
0 |
0 |
0.029 |
24 |
28 |
|
[IOD]A:203 |
1 |
1 |
144 |
f |
B |
x-1/2,y-1/2,z |
3_445 |
4 |
2 |
9645 |
43.1 |
-0.6 |
0.397 |
0 |
0 |
0 |
0.034 |
25 |
29 |
|
A |
5 |
3 |
9486 |
◊ |
[EDO]A:205 |
-x+1/2,y-1/2,-z+1 |
4_546 |
3 |
1 |
187 |
41.3 |
2.3 |
0.970 |
0 |
0 |
0 |
0.000 |
26 |
30 |
|
B |
7 |
4 |
9645 |
f |
[IOD]B:201 |
-x+1/2,y-1/2,-z |
4_545 |
1 |
1 |
144 |
39.3 |
-0.0 |
0.770 |
0 |
0 |
0 |
0.100 |
31 |
|
A |
6 |
3 |
9486 |
f |
[IOD]A:200 |
-x+1/2,y-1/2,-z+1 |
4_546 |
1 |
1 |
144 |
38.7 |
-0.1 |
0.729 |
0 |
0 |
0 |
0.100 |
Average: |
39.0 |
-0.1 |
0.749 |
0 |
0 |
0 |
0.100 |
27 |
32 |
|
[IOD]A:202 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
9486 |
38.1 |
0.0 |
0.780 |
0 |
0 |
0 |
0.000 |
28 |
33 |
|
[IOD]B:198 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
3 |
3 |
9486 |
37.4 |
-0.3 |
0.483 |
0 |
0 |
0 |
0.285 |
34 |
|
[IOD]A:201 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
3 |
3 |
9645 |
36.6 |
-0.3 |
0.461 |
0 |
0 |
0 |
0.285 |
Average: |
37.0 |
-0.3 |
0.472 |
0 |
0 |
0 |
0.285 |
29 |
35 |
|
[EDO]A:207 |
3 |
1 |
183 |
f |
B |
x-1/2,y-1/2,z |
3_445 |
4 |
1 |
9645 |
36.4 |
0.6 |
0.510 |
0 |
0 |
0 |
0.000 |
30 |
36 |
|
[IOD]B:198 |
1 |
1 |
144 |
◊ |
[IOD]A:201 |
x,y,z |
1_555 |
1 |
1 |
144 |
31.7 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
31 |
37 |
|
[EDO]A:205 |
4 |
1 |
187 |
◊ |
[IOD]A:202 |
x,y,z |
1_555 |
1 |
1 |
144 |
19.3 |
0.5 |
1.000 |
0 |
0 |
0 |
0.000 |
32 |
38 |
|
B |
1 |
1 |
9645 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
2 |
1 |
9486 |
14.6 |
-0.5 |
0.208 |
0 |
0 |
0 |
0.000 |
33 |
39 |
|
B |
4 |
1 |
9645 |
x |
B |
x-1/2,y+1/2,z |
3_455 |
2 |
1 |
9645 |
14.3 |
0.3 |
0.755 |
0 |
0 |
0 |
0.000 |
34 |
40 |
|
[EDO]A:206 |
1 |
1 |
184 |
f |
A |
-x,y,-z+1 |
2_556 |
4 |
1 |
9486 |
11.3 |
0.1 |
0.772 |
0 |
0 |
0 |
0.000 |
35 |
41 |
|
[IOD]B:199 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
9486 |
2.1 |
0.0 |
0.876 |
0 |
0 |
0 |
0.000 |
36 |
42 |
|
[EDO]A:204 |
1 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
9645 |
1.4 |
0.0 |
0.854 |
0 |
0 |
0 |
0.000 |
|