## |
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 |
|
D |
486 |
123 |
17380 |
◊ |
C |
x,y,z |
1_555 |
490 |
125 |
15874 |
4884.5 |
-99.4 |
0.846 |
26 |
6 |
1 |
0.865 |
2 |
|
B |
483 |
123 |
16862 |
◊ |
A |
x,y,z |
1_555 |
486 |
125 |
17354 |
4866.0 |
-98.7 |
0.880 |
28 |
7 |
1 |
0.865 |
Average: |
4875.3 |
-99.1 |
0.863 |
27 |
7 |
1 |
0.865 |
2 |
3 |
|
D |
25 |
6 |
17380 |
◊ |
A |
x,y,z |
1_555 |
23 |
6 |
17354 |
238.6 |
2.3 |
0.992 |
6 |
4 |
0 |
0.000 |
3 |
4 |
|
[PC1]D:402 |
9 |
1 |
357 |
f |
D |
x,y,z |
1_555 |
28 |
10 |
17380 |
199.8 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.046 |
4 |
5 |
|
[PC1]A:603 |
11 |
1 |
414 |
f |
A |
x,y,z |
1_555 |
31 |
11 |
17354 |
197.9 |
-5.4 |
0.500 |
0 |
0 |
0 |
0.040 |
6 |
|
[PC1]D:403 |
8 |
1 |
325 |
f |
D |
x,y,z |
1_555 |
19 |
8 |
17380 |
139.3 |
-3.7 |
0.691 |
0 |
0 |
0 |
0.040 |
Average: |
168.6 |
-4.6 |
0.595 |
0 |
0 |
0 |
0.040 |
5 |
7 |
|
[PC1]A:606 |
8 |
1 |
327 |
f |
A |
x,y,z |
1_555 |
29 |
10 |
17354 |
195.8 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.045 |
6 |
8 |
|
[40D]B:402 |
12 |
1 |
327 |
f |
B |
x,y,z |
1_555 |
22 |
7 |
16862 |
153.8 |
-1.0 |
0.460 |
0 |
0 |
0 |
0.100 |
9 |
|
[40D]D:404 |
12 |
1 |
323 |
f |
D |
x,y,z |
1_555 |
23 |
8 |
17380 |
152.6 |
-0.9 |
0.440 |
0 |
0 |
0 |
0.100 |
10 |
|
[40D]C:604 |
11 |
1 |
326 |
f |
C |
x,y,z |
1_555 |
15 |
7 |
15874 |
152.3 |
-1.4 |
0.328 |
0 |
0 |
0 |
0.100 |
11 |
|
[40D]A:605 |
11 |
1 |
326 |
f |
A |
x,y,z |
1_555 |
23 |
8 |
17354 |
151.4 |
-0.8 |
0.492 |
0 |
0 |
0 |
0.100 |
Average: |
152.5 |
-1.0 |
0.430 |
0 |
0 |
0 |
0.100 |
7 |
12 |
|
D |
15 |
5 |
17380 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
19 |
7 |
16862 |
139.5 |
-1.2 |
0.860 |
1 |
0 |
0 |
0.000 |
8 |
13 |
|
A |
15 |
6 |
17354 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
11 |
3 |
16862 |
110.9 |
-1.8 |
0.721 |
0 |
0 |
0 |
0.000 |
9 |
14 |
|
B |
7 |
3 |
16862 |
x |
B |
-x,y-1/2,-z+1/2 |
3_545 |
13 |
5 |
16862 |
96.3 |
-1.9 |
0.456 |
1 |
0 |
0 |
0.000 |
10 |
15 |
|
[40D]A:605 |
6 |
1 |
326 |
◊ |
B |
x,y,z |
1_555 |
11 |
4 |
16862 |
86.9 |
-0.6 |
0.475 |
0 |
0 |
0 |
0.008 |
16 |
|
[40D]D:404 |
6 |
1 |
323 |
◊ |
C |
x,y,z |
1_555 |
11 |
4 |
15874 |
83.2 |
-0.5 |
0.479 |
0 |
0 |
0 |
0.008 |
17 |
|
[40D]C:604 |
4 |
1 |
326 |
◊ |
D |
x,y,z |
1_555 |
11 |
4 |
17380 |
75.4 |
-0.5 |
0.498 |
0 |
0 |
0 |
0.008 |
18 |
|
[40D]B:402 |
4 |
1 |
327 |
◊ |
A |
x,y,z |
1_555 |
12 |
4 |
17354 |
72.2 |
-0.6 |
0.539 |
0 |
0 |
0 |
0.008 |
Average: |
79.4 |
-0.5 |
0.498 |
0 |
0 |
0 |
0.008 |
11 |
19 |
|
A |
8 |
3 |
17354 |
x |
A |
x-1/2,-y+5/2,-z |
4_475 |
11 |
5 |
17354 |
78.1 |
-0.3 |
0.826 |
0 |
0 |
0 |
0.000 |
12 |
20 |
|
B |
9 |
2 |
16862 |
◊ |
D |
x-1/2,-y+5/2,-z |
4_475 |
11 |
3 |
17380 |
73.6 |
-1.3 |
0.624 |
0 |
0 |
0 |
0.000 |
13 |
21 |
|
A |
13 |
6 |
17354 |
◊ |
C |
x-1/2,-y+5/2,-z |
4_475 |
9 |
5 |
15874 |
69.7 |
-1.8 |
0.638 |
0 |
0 |
0 |
0.000 |
14 |
22 |
|
[K]A:602 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
12 |
5 |
16862 |
64.5 |
-41.8 |
0.000 |
0 |
0 |
0 |
0.177 |
23 |
|
[K]C:603 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
14 |
5 |
15874 |
64.1 |
-41.5 |
0.000 |
0 |
0 |
0 |
0.177 |
24 |
|
[K]C:603 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
13 |
5 |
17380 |
62.5 |
-39.3 |
0.000 |
0 |
0 |
0 |
0.177 |
25 |
|
[K]A:602 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
12 |
5 |
17354 |
62.0 |
-39.5 |
0.000 |
0 |
0 |
0 |
0.177 |
Average: |
63.3 |
-40.5 |
0.000 |
0 |
0 |
0 |
0.177 |
15 |
26 |
|
[K]A:601 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
14 |
9 |
17354 |
62.6 |
-42.0 |
0.000 |
0 |
0 |
0 |
0.182 |
27 |
|
[K]A:601 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
14 |
9 |
16862 |
62.6 |
-41.8 |
0.000 |
0 |
0 |
0 |
0.182 |
28 |
|
[K]C:601 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
14 |
9 |
17380 |
62.0 |
-41.5 |
0.000 |
0 |
0 |
0 |
0.182 |
29 |
|
[K]C:601 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
14 |
9 |
15874 |
61.9 |
-41.9 |
0.000 |
0 |
0 |
0 |
0.182 |
Average: |
62.3 |
-41.8 |
0.000 |
0 |
0 |
0 |
0.182 |
16 |
30 |
|
[K]B:401 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
15 |
6 |
16862 |
56.6 |
-37.2 |
0.000 |
0 |
0 |
0 |
0.162 |
31 |
|
[K]C:602 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
15 |
6 |
15874 |
56.5 |
-37.4 |
0.000 |
0 |
0 |
0 |
0.162 |
32 |
|
[K]B:401 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
16 |
6 |
17354 |
56.5 |
-36.6 |
0.000 |
0 |
0 |
0 |
0.162 |
33 |
|
[K]C:602 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
16 |
6 |
17380 |
56.1 |
-36.5 |
0.000 |
0 |
0 |
0 |
0.162 |
Average: |
56.4 |
-36.9 |
0.000 |
0 |
0 |
0 |
0.162 |
17 |
34 |
|
D |
5 |
2 |
17380 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
7 |
2 |
17354 |
47.2 |
0.1 |
0.751 |
0 |
0 |
0 |
0.000 |
18 |
35 |
|
[CD]D:401 |
1 |
1 |
112 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
17354 |
41.6 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.000 |
36 |
|
[CD]A:604 |
1 |
1 |
112 |
◊ |
D |
x,y,z |
1_555 |
10 |
3 |
17380 |
41.1 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
41.4 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.000 |
19 |
37 |
|
[CD]D:401 |
1 |
1 |
112 |
f |
D |
x,y,z |
1_555 |
6 |
2 |
17380 |
41.0 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.028 |
38 |
|
[CD]A:604 |
1 |
1 |
112 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
17354 |
40.0 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.028 |
Average: |
40.5 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.028 |
20 |
39 |
|
[K]C:603 |
1 |
1 |
216 |
f |
[K]C:602 |
x,y,z |
1_555 |
1 |
1 |
216 |
37.9 |
-37.9 |
0.000 |
0 |
0 |
0 |
0.083 |
21 |
40 |
|
[K]B:401 |
1 |
1 |
216 |
f |
[K]A:602 |
x,y,z |
1_555 |
1 |
1 |
216 |
37.4 |
-37.4 |
0.000 |
0 |
0 |
0 |
0.082 |
22 |
41 |
|
[K]B:401 |
1 |
1 |
216 |
f |
[K]A:601 |
x,y,z |
1_555 |
1 |
1 |
216 |
36.4 |
-36.4 |
0.000 |
0 |
0 |
0 |
0.079 |
23 |
42 |
|
[K]C:602 |
1 |
1 |
216 |
f |
[K]C:601 |
x,y,z |
1_555 |
1 |
1 |
216 |
35.5 |
-35.5 |
0.000 |
0 |
0 |
0 |
0.078 |
24 |
43 |
|
[CD]A:604 |
1 |
1 |
112 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
16862 |
15.4 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.009 |
44 |
|
[CD]D:401 |
1 |
1 |
112 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
15874 |
13.7 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.009 |
Average: |
14.5 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.009 |
25 |
45 |
|
[K]C:603 |
1 |
1 |
216 |
f |
[K]C:601 |
x,y,z |
1_555 |
1 |
1 |
216 |
12.1 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.027 |
26 |
46 |
|
[K]A:602 |
1 |
1 |
216 |
f |
[K]A:601 |
x,y,z |
1_555 |
1 |
1 |
216 |
10.9 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.024 |
27 |
47 |
|
D |
1 |
1 |
17380 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
16862 |
10.1 |
0.2 |
0.881 |
0 |
0 |
0 |
0.000 |
48 |
|
C |
2 |
1 |
15874 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
17354 |
7.2 |
0.2 |
0.859 |
0 |
0 |
0 |
0.000 |
Average: |
8.6 |
0.2 |
0.870 |
0 |
0 |
0 |
0.000 |
|