## |
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 |
466 |
115 |
19795 |
◊ |
A |
x,y,z |
1_555 |
468 |
116 |
18900 |
4639.5 |
-88.4 |
0.696 |
31 |
8 |
1 |
1.000 |
2 |
2 |
|
B |
28 |
10 |
19795 |
x |
B |
-x,y-1/2,-z-1/2 |
3_544 |
28 |
8 |
19795 |
268.3 |
-2.0 |
0.859 |
1 |
0 |
0 |
0.000 |
3 |
3 |
|
A |
20 |
6 |
18900 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
22 |
5 |
18900 |
205.1 |
-4.2 |
0.490 |
0 |
0 |
0 |
0.000 |
4 |
4 |
|
B |
23 |
6 |
19795 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
18 |
6 |
18900 |
171.5 |
-1.3 |
0.836 |
0 |
2 |
0 |
0.017 |
5 |
5 |
|
A |
18 |
6 |
18900 |
◊ |
B |
-x,y-1/2,-z-1/2 |
3_544 |
18 |
6 |
19795 |
153.0 |
-0.3 |
0.870 |
1 |
1 |
0 |
0.000 |
6 |
6 |
|
[RU3]A:401 |
10 |
1 |
407 |
◊ |
B |
x,y,z |
1_555 |
22 |
7 |
19795 |
136.3 |
1.2 |
0.599 |
3 |
0 |
0 |
0.000 |
7 |
7 |
|
[RU3]A:401 |
11 |
1 |
407 |
◊ |
A |
x,y,z |
1_555 |
21 |
7 |
18900 |
136.2 |
0.9 |
0.483 |
2 |
0 |
0 |
0.000 |
8 |
8 |
|
[OCT]B:406 |
8 |
1 |
324 |
f |
B |
x,y,z |
1_555 |
19 |
7 |
19795 |
133.8 |
3.8 |
0.899 |
0 |
0 |
0 |
0.000 |
9 |
9 |
|
[OCT]A:406 |
8 |
1 |
323 |
◊ |
A |
x,y,z |
1_555 |
12 |
5 |
18900 |
122.9 |
2.4 |
0.599 |
0 |
0 |
0 |
0.000 |
10 |
10 |
|
B |
20 |
4 |
19795 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
13 |
3 |
18900 |
120.7 |
-0.8 |
0.824 |
2 |
0 |
0 |
0.000 |
11 |
11 |
|
[OCT]B:405 |
5 |
1 |
314 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
19795 |
95.9 |
1.8 |
0.567 |
0 |
0 |
0 |
0.000 |
12 |
12 |
|
[LNK]A:408 |
5 |
1 |
242 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
18900 |
94.2 |
2.3 |
0.823 |
0 |
0 |
0 |
0.000 |
13 |
13 |
|
[HEX]B:407 |
6 |
1 |
268 |
◊ |
B |
x,y,z |
1_555 |
14 |
5 |
19795 |
89.1 |
2.1 |
0.804 |
0 |
0 |
0 |
0.000 |
14 |
14 |
|
[OCT]A:407 |
7 |
1 |
325 |
◊ |
[OCT]A:406 |
x,y,z |
1_555 |
8 |
1 |
323 |
75.0 |
5.0 |
1.000 |
0 |
0 |
0 |
0.000 |
15 |
15 |
|
[OCT]A:407 |
7 |
1 |
325 |
f |
A |
x,y,z |
1_555 |
7 |
5 |
18900 |
66.3 |
1.1 |
0.586 |
0 |
0 |
0 |
0.000 |
16 |
16 |
|
[K]B:404 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
11 |
7 |
18900 |
62.5 |
-39.7 |
0.000 |
0 |
0 |
0 |
0.129 |
17 |
|
[K]B:404 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
10 |
7 |
19795 |
61.2 |
-39.1 |
0.000 |
0 |
0 |
0 |
0.129 |
Average: |
61.8 |
-39.4 |
0.000 |
0 |
0 |
0 |
0.129 |
17 |
18 |
|
[OCT]B:406 |
5 |
1 |
324 |
f |
[OCT]B:405 |
x,y,z |
1_555 |
6 |
1 |
314 |
57.8 |
3.8 |
1.000 |
0 |
0 |
0 |
0.000 |
18 |
19 |
|
[K]A:405 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
9 |
5 |
18900 |
56.7 |
-37.2 |
0.000 |
0 |
0 |
0 |
0.103 |
20 |
|
[K]A:405 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
19795 |
41.4 |
-26.0 |
0.000 |
0 |
0 |
0 |
0.103 |
Average: |
49.0 |
-31.6 |
0.000 |
0 |
0 |
0 |
0.103 |
19 |
21 |
|
[K]B:403 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
18900 |
54.9 |
-34.9 |
0.000 |
0 |
0 |
0 |
0.115 |
22 |
|
[K]B:403 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
13 |
4 |
19795 |
54.8 |
-35.7 |
0.000 |
0 |
0 |
0 |
0.115 |
Average: |
54.8 |
-35.3 |
0.000 |
0 |
0 |
0 |
0.115 |
20 |
23 |
|
[K]A:404 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
15 |
8 |
18900 |
53.5 |
-34.9 |
0.000 |
0 |
0 |
0 |
0.225 |
24 |
|
[K]A:403 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
14 |
6 |
18900 |
52.6 |
-35.0 |
0.000 |
0 |
0 |
0 |
0.225 |
25 |
|
[K]A:404 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
16 |
9 |
19795 |
52.5 |
-34.2 |
0.000 |
0 |
0 |
0 |
0.225 |
26 |
|
[K]A:403 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
14 |
6 |
19795 |
51.9 |
-33.6 |
0.000 |
0 |
0 |
0 |
0.225 |
Average: |
52.6 |
-34.4 |
0.000 |
0 |
0 |
0 |
0.225 |
21 |
27 |
|
[CD]B:401 |
1 |
1 |
112 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
19795 |
47.3 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.047 |
22 |
28 |
|
[K]B:403 |
1 |
1 |
216 |
f |
[K]A:405 |
x,y,z |
1_555 |
1 |
1 |
216 |
40.4 |
-40.4 |
0.000 |
0 |
0 |
0 |
0.066 |
23 |
29 |
|
[OCT]A:406 |
4 |
1 |
323 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
19795 |
39.5 |
0.7 |
0.691 |
0 |
0 |
0 |
0.000 |
24 |
30 |
|
[CD]A:402 |
1 |
1 |
112 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
18900 |
38.8 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.110 |
31 |
|
[CD]B:402 |
1 |
1 |
112 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
19795 |
38.4 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.110 |
32 |
|
[CD]B:402 |
1 |
1 |
112 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
5 |
2 |
18900 |
36.1 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.110 |
Average: |
37.8 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.110 |
25 |
33 |
|
[K]B:404 |
1 |
1 |
216 |
f |
[K]A:404 |
x,y,z |
1_555 |
1 |
1 |
216 |
36.6 |
-36.6 |
0.000 |
0 |
0 |
0 |
0.060 |
26 |
34 |
|
[HEX]B:407 |
3 |
1 |
268 |
f |
A |
x,y,z |
1_555 |
3 |
2 |
18900 |
36.2 |
0.6 |
0.555 |
0 |
0 |
0 |
0.000 |
27 |
35 |
|
[K]A:404 |
1 |
1 |
216 |
f |
[K]A:403 |
x,y,z |
1_555 |
1 |
1 |
216 |
33.7 |
-33.7 |
0.000 |
0 |
0 |
0 |
0.055 |
28 |
36 |
|
B |
7 |
2 |
19795 |
◊ |
[CD]A:402 |
-x+1/2,-y,z-1/2 |
2_554 |
1 |
1 |
112 |
33.4 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.033 |
29 |
37 |
|
[K]B:403 |
1 |
1 |
216 |
f |
[K]A:403 |
x,y,z |
1_555 |
1 |
1 |
216 |
31.8 |
-31.8 |
0.000 |
0 |
0 |
0 |
0.052 |
30 |
38 |
|
[CD]B:402 |
1 |
1 |
112 |
f |
[CD]A:402 |
-x+1/2,-y,z-1/2 |
2_554 |
1 |
1 |
112 |
27.6 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.100 |
31 |
39 |
|
B |
6 |
3 |
19795 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
1 |
1 |
18900 |
17.4 |
0.6 |
0.881 |
0 |
0 |
0 |
0.000 |
32 |
40 |
|
[K]B:404 |
1 |
1 |
216 |
f |
[K]A:403 |
x,y,z |
1_555 |
1 |
1 |
216 |
14.5 |
-14.5 |
0.000 |
0 |
0 |
0 |
0.024 |
33 |
41 |
|
[K]B:403 |
1 |
1 |
216 |
f |
[K]A:404 |
x,y,z |
1_555 |
1 |
1 |
216 |
10.5 |
-10.5 |
0.000 |
0 |
0 |
0 |
0.017 |
34 |
42 |
|
[CD]B:401 |
1 |
1 |
112 |
◊ |
B |
-x,y-1/2,-z-1/2 |
3_544 |
2 |
2 |
19795 |
9.6 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.000 |
35 |
43 |
|
[K]B:404 |
1 |
1 |
216 |
f |
[RU3]A:401 |
x,y,z |
1_555 |
1 |
1 |
407 |
4.7 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.003 |
36 |
44 |
|
[K]A:405 |
1 |
1 |
216 |
f |
[K]A:403 |
x,y,z |
1_555 |
1 |
1 |
216 |
3.7 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.006 |
37 |
45 |
|
A |
1 |
1 |
18900 |
x |
A |
-x,y-1/2,-z-1/2 |
3_544 |
1 |
1 |
18900 |
1.3 |
-0.0 |
0.696 |
0 |
0 |
0 |
0.000 |
|