## |
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 |
165 |
39 |
8907 |
◊ |
A |
x,y,z |
1_555 |
163 |
39 |
9226 |
1519.2 |
-13.1 |
0.427 |
41 |
19 |
0 |
0.788 |
2 |
|
D |
156 |
39 |
9073 |
◊ |
C |
x,y,z |
1_555 |
160 |
39 |
8753 |
1473.9 |
-16.0 |
0.334 |
43 |
18 |
0 |
0.788 |
Average: |
1496.5 |
-14.6 |
0.380 |
42 |
19 |
0 |
0.788 |
2 |
3 |
|
D |
66 |
21 |
9073 |
x |
D |
-x+1,y-1/2,-z+1 |
2_646 |
56 |
16 |
9073 |
616.0 |
-5.0 |
0.315 |
9 |
3 |
0 |
0.000 |
4 |
|
A |
67 |
19 |
9226 |
x |
A |
-x,y-1/2,-z |
2_545 |
57 |
16 |
9226 |
605.5 |
-4.9 |
0.372 |
9 |
0 |
0 |
0.000 |
Average: |
610.8 |
-4.9 |
0.343 |
9 |
2 |
0 |
0.000 |
3 |
5 |
|
C |
52 |
16 |
8753 |
◊ |
B |
x-1,y,z |
1_455 |
36 |
8 |
8907 |
450.4 |
-6.2 |
0.118 |
5 |
0 |
0 |
0.000 |
6 |
|
C |
35 |
11 |
8753 |
◊ |
B |
x-1,y-1,z |
1_445 |
54 |
16 |
8907 |
439.6 |
-5.2 |
0.273 |
6 |
0 |
0 |
0.000 |
Average: |
445.0 |
-5.7 |
0.195 |
6 |
0 |
0 |
0.000 |
4 |
7 |
|
D |
25 |
10 |
9073 |
◊ |
B |
x,y-1,z |
1_545 |
22 |
7 |
8907 |
284.7 |
-7.7 |
0.031 |
0 |
0 |
0 |
0.073 |
5 |
8 |
|
C |
18 |
5 |
8753 |
◊ |
A |
x,y,z |
1_555 |
15 |
6 |
9226 |
220.4 |
-6.4 |
0.031 |
0 |
0 |
0 |
0.000 |
6 |
9 |
|
A |
23 |
8 |
9226 |
◊ |
B |
x,y-1,z |
1_545 |
20 |
9 |
8907 |
202.2 |
1.0 |
0.771 |
1 |
1 |
0 |
0.000 |
10 |
|
D |
22 |
7 |
9073 |
◊ |
C |
x,y-1,z |
1_545 |
19 |
8 |
8753 |
189.7 |
1.7 |
0.834 |
3 |
2 |
0 |
0.000 |
Average: |
196.0 |
1.4 |
0.803 |
2 |
2 |
0 |
0.000 |
7 |
11 |
|
C |
17 |
3 |
8753 |
◊ |
B |
x,y-1,z |
1_545 |
17 |
6 |
8907 |
171.4 |
-0.4 |
0.584 |
0 |
2 |
0 |
0.006 |
8 |
12 |
|
C |
18 |
7 |
8753 |
◊ |
A |
x-1,y,z |
1_455 |
11 |
5 |
9226 |
148.3 |
0.4 |
0.711 |
2 |
2 |
0 |
0.000 |
13 |
|
D |
12 |
6 |
9073 |
◊ |
B |
x-1,y-1,z |
1_445 |
21 |
7 |
8907 |
146.9 |
-1.1 |
0.416 |
0 |
1 |
0 |
0.000 |
Average: |
147.6 |
-0.4 |
0.563 |
1 |
2 |
0 |
0.000 |
9 |
14 |
|
[EDO]C:201 |
4 |
1 |
184 |
◊ |
C |
x,y,z |
1_555 |
14 |
4 |
8753 |
78.9 |
2.6 |
0.309 |
1 |
0 |
0 |
0.000 |
10 |
15 |
|
[EDO]B:203 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
15 |
6 |
8907 |
72.7 |
1.9 |
0.280 |
0 |
0 |
0 |
0.000 |
11 |
16 |
|
A |
8 |
3 |
9226 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
9 |
3 |
8907 |
71.0 |
-0.1 |
0.635 |
0 |
0 |
0 |
0.000 |
17 |
|
D |
6 |
2 |
9073 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
6 |
3 |
8753 |
62.4 |
0.3 |
0.709 |
1 |
0 |
0 |
0.000 |
Average: |
66.7 |
0.1 |
0.672 |
1 |
0 |
0 |
0.000 |
12 |
18 |
|
B |
9 |
2 |
8907 |
x |
B |
x-1,y,z |
1_455 |
7 |
2 |
8907 |
70.2 |
-0.3 |
0.596 |
0 |
1 |
0 |
0.000 |
13 |
19 |
|
[EDO]D:202 |
4 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
12 |
4 |
9073 |
68.7 |
0.7 |
0.632 |
0 |
0 |
0 |
0.000 |
14 |
20 |
|
C |
5 |
4 |
8753 |
◊ |
B |
x,y,z |
1_555 |
9 |
2 |
8907 |
57.6 |
-0.5 |
0.476 |
0 |
0 |
0 |
0.000 |
15 |
21 |
|
[CA]D:201 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
7 |
3 |
9073 |
35.1 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.145 |
16 |
22 |
|
A |
5 |
3 |
9226 |
f |
[CA]B:201 |
x,y-1,z |
1_545 |
1 |
1 |
85 |
32.8 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.132 |
23 |
|
[CA]C:202 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
5 |
3 |
9073 |
30.5 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.132 |
Average: |
31.6 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.132 |
17 |
24 |
|
[CA]B:202 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
8907 |
30.6 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.125 |
18 |
25 |
|
[EDO]C:201 |
2 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
6 |
2 |
9073 |
30.1 |
1.0 |
0.869 |
0 |
0 |
0 |
0.000 |
19 |
26 |
|
A |
5 |
2 |
9226 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
3 |
1 |
8907 |
28.9 |
0.4 |
0.721 |
0 |
0 |
0 |
0.000 |
20 |
27 |
|
C |
7 |
4 |
8753 |
◊ |
[CA]B:202 |
x,y-1,z |
1_545 |
1 |
1 |
85 |
28.8 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.046 |
21 |
28 |
|
[CA]D:201 |
1 |
1 |
85 |
◊ |
C |
x,y-1,z |
1_545 |
4 |
2 |
8753 |
28.7 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.000 |
22 |
29 |
|
[CA]C:202 |
1 |
1 |
85 |
◊ |
C |
x,y-1,z |
1_545 |
3 |
1 |
8753 |
27.9 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.000 |
30 |
|
[CA]B:201 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
8907 |
27.6 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
27.7 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.000 |
23 |
31 |
|
[EDO]D:202 |
2 |
1 |
185 |
f |
C |
x,y-1,z |
1_545 |
6 |
2 |
8753 |
25.5 |
0.7 |
0.849 |
0 |
0 |
0 |
0.000 |
24 |
32 |
|
A |
2 |
1 |
9226 |
x |
A |
x-1,y+1,z |
1_465 |
1 |
1 |
9226 |
15.0 |
0.1 |
0.395 |
0 |
0 |
0 |
0.000 |
25 |
33 |
|
C |
2 |
1 |
8753 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
3 |
1 |
9226 |
12.5 |
-0.3 |
0.460 |
0 |
0 |
0 |
0.000 |
26 |
34 |
|
[CA]D:201 |
1 |
1 |
85 |
f |
[CA]C:202 |
x,y,z |
1_555 |
1 |
1 |
85 |
6.7 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.042 |
27 |
35 |
|
D |
1 |
1 |
9073 |
◊ |
[CA]B:202 |
x,y-1,z |
1_545 |
1 |
1 |
85 |
1.7 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.003 |
28 |
36 |
|
[EDO]B:203 |
1 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
9226 |
1.6 |
-0.0 |
0.724 |
0 |
0 |
0 |
0.000 |
|