## |
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 |
|
H |
120 |
32 |
6094 |
◊ |
G |
x,y,z |
1_555 |
104 |
28 |
6716 |
1104.9 |
-16.8 |
0.167 |
14 |
2 |
0 |
1.000 |
2 |
|
E |
116 |
31 |
6196 |
◊ |
D |
x,y,z |
1_555 |
105 |
29 |
6640 |
1099.6 |
-16.4 |
0.172 |
14 |
1 |
0 |
1.000 |
3 |
|
K |
121 |
32 |
5948 |
◊ |
J |
x,y,z |
1_555 |
105 |
28 |
6695 |
1098.2 |
-16.2 |
0.185 |
14 |
1 |
0 |
1.000 |
4 |
|
B |
118 |
31 |
5964 |
◊ |
A |
x,y,z |
1_555 |
103 |
28 |
6833 |
1089.1 |
-16.3 |
0.139 |
13 |
1 |
0 |
1.000 |
Average: |
1097.9 |
-16.4 |
0.166 |
14 |
1 |
0 |
1.000 |
2 |
5 |
|
F |
102 |
29 |
8892 |
◊ |
E |
x,y,z |
1_555 |
117 |
28 |
6196 |
1019.5 |
-17.1 |
0.122 |
8 |
7 |
0 |
0.739 |
6 |
|
I |
100 |
28 |
8798 |
◊ |
H |
x,y,z |
1_555 |
110 |
25 |
6094 |
1007.2 |
-17.1 |
0.129 |
9 |
7 |
0 |
0.739 |
7 |
|
C |
96 |
28 |
8724 |
◊ |
B |
x,y,z |
1_555 |
114 |
26 |
5964 |
1006.1 |
-17.2 |
0.101 |
7 |
5 |
0 |
0.739 |
8 |
|
L |
101 |
28 |
8888 |
◊ |
K |
x,y,z |
1_555 |
106 |
25 |
5948 |
979.5 |
-17.0 |
0.113 |
8 |
7 |
0 |
0.739 |
Average: |
1003.1 |
-17.1 |
0.116 |
8 |
7 |
0 |
0.739 |
3 |
9 |
|
L |
64 |
21 |
8888 |
◊ |
L |
x,-y+1,-z+1/2 |
6_565 |
64 |
21 |
8888 |
629.6 |
-0.6 |
0.806 |
10 |
6 |
0 |
0.000 |
10 |
|
F |
40 |
14 |
8892 |
◊ |
F |
x,-y,-z+1/2 |
6_555 |
40 |
14 |
8892 |
444.9 |
-0.2 |
0.770 |
4 |
6 |
0 |
0.000 |
11 |
|
C |
42 |
15 |
8724 |
◊ |
C |
x,-y+1,-z+1/2 |
6_565 |
42 |
15 |
8724 |
435.5 |
-1.1 |
0.717 |
2 |
6 |
0 |
0.000 |
Average: |
503.3 |
-0.6 |
0.764 |
5 |
6 |
0 |
0.000 |
4 |
12 |
|
I |
65 |
21 |
8798 |
◊ |
I |
x,-y,-z+1/2 |
6_555 |
65 |
21 |
8798 |
617.6 |
0.2 |
0.862 |
8 |
4 |
0 |
0.000 |
5 |
13 |
|
I |
49 |
13 |
8798 |
◊ |
E |
x-1,y,z |
1_455 |
51 |
12 |
6196 |
519.2 |
-2.8 |
0.653 |
2 |
3 |
0 |
0.000 |
14 |
|
L |
47 |
13 |
8888 |
◊ |
B |
x-1,y,z |
1_455 |
48 |
11 |
5964 |
516.5 |
-3.8 |
0.536 |
2 |
3 |
0 |
0.000 |
Average: |
517.9 |
-3.3 |
0.594 |
2 |
3 |
0 |
0.000 |
6 |
15 |
|
A |
45 |
12 |
6833 |
◊ |
A |
-y+1,-x+1,-z+1/4 |
8_665 |
45 |
12 |
6833 |
502.1 |
2.4 |
0.895 |
10 |
0 |
0 |
0.000 |
16 |
|
J |
45 |
12 |
6695 |
◊ |
D |
-y,-x+1,-z+1/4 |
8_565 |
41 |
11 |
6640 |
479.6 |
1.9 |
0.882 |
8 |
0 |
0 |
0.000 |
Average: |
490.9 |
2.1 |
0.888 |
9 |
0 |
0 |
0.000 |
7 |
17 |
|
G |
46 |
13 |
6716 |
◊ |
G |
-y,-x,-z+1/4 |
8_555 |
46 |
13 |
6716 |
478.3 |
2.2 |
0.891 |
10 |
0 |
0 |
0.000 |
8 |
18 |
|
C |
54 |
17 |
8724 |
◊ |
K |
x,y,z |
1_555 |
58 |
13 |
5948 |
476.0 |
-6.6 |
0.370 |
2 |
4 |
0 |
0.000 |
19 |
|
F |
52 |
17 |
8892 |
◊ |
H |
x,y,z |
1_555 |
52 |
14 |
6094 |
468.3 |
-5.4 |
0.416 |
3 |
4 |
0 |
0.000 |
Average: |
472.1 |
-6.0 |
0.393 |
3 |
4 |
0 |
0.000 |
9 |
20 |
|
[9BK]F:301 |
33 |
1 |
817 |
f |
F |
x,y,z |
1_555 |
61 |
18 |
8892 |
444.1 |
-7.2 |
0.608 |
5 |
0 |
0 |
0.303 |
21 |
|
[9BK]I:301 |
34 |
1 |
817 |
f |
I |
x,y,z |
1_555 |
60 |
17 |
8798 |
442.6 |
-6.2 |
0.727 |
5 |
0 |
0 |
0.303 |
22 |
|
[9BK]C:301 |
34 |
1 |
816 |
f |
C |
x,y,z |
1_555 |
64 |
19 |
8724 |
442.3 |
-6.1 |
0.711 |
5 |
0 |
0 |
0.303 |
23 |
|
[9BK]L:301 |
33 |
1 |
814 |
f |
L |
x,y,z |
1_555 |
60 |
17 |
8888 |
442.1 |
-5.8 |
0.737 |
4 |
0 |
0 |
0.303 |
Average: |
442.8 |
-6.3 |
0.696 |
5 |
0 |
0 |
0.303 |
10 |
24 |
|
L |
28 |
11 |
8888 |
◊ |
I |
x,-y+1,-z+1/2 |
6_565 |
25 |
8 |
8798 |
273.0 |
-2.2 |
0.515 |
2 |
2 |
0 |
0.000 |
25 |
|
F |
23 |
8 |
8892 |
◊ |
C |
x,-y+1,-z+1/2 |
6_565 |
28 |
11 |
8724 |
257.4 |
-1.9 |
0.517 |
2 |
1 |
0 |
0.000 |
Average: |
265.2 |
-2.1 |
0.516 |
2 |
2 |
0 |
0.000 |
11 |
26 |
|
J |
23 |
9 |
6695 |
◊ |
A |
-y+1,-x+1,-z+1/4 |
8_665 |
31 |
8 |
6833 |
232.1 |
2.7 |
0.870 |
5 |
8 |
0 |
0.000 |
27 |
|
J |
29 |
8 |
6695 |
◊ |
G |
-y,-x+1,-z+1/4 |
8_565 |
19 |
7 |
6716 |
211.4 |
1.6 |
0.848 |
5 |
7 |
0 |
0.000 |
Average: |
221.8 |
2.1 |
0.859 |
5 |
8 |
0 |
0.000 |
12 |
28 |
|
C |
22 |
7 |
8724 |
◊ |
A |
x,y,z |
1_555 |
17 |
5 |
6833 |
187.8 |
-4.6 |
0.125 |
0 |
0 |
0 |
0.082 |
29 |
|
I |
22 |
8 |
8798 |
◊ |
G |
x,y,z |
1_555 |
14 |
4 |
6716 |
176.6 |
-4.6 |
0.105 |
0 |
0 |
0 |
0.082 |
30 |
|
L |
20 |
7 |
8888 |
◊ |
J |
x,y,z |
1_555 |
15 |
4 |
6695 |
176.2 |
-4.5 |
0.115 |
0 |
0 |
0 |
0.082 |
31 |
|
F |
20 |
7 |
8892 |
◊ |
D |
x,y,z |
1_555 |
13 |
4 |
6640 |
161.9 |
-4.3 |
0.120 |
0 |
0 |
0 |
0.082 |
Average: |
175.6 |
-4.5 |
0.116 |
0 |
0 |
0 |
0.082 |
13 |
32 |
|
[9BK]C:301 |
6 |
1 |
816 |
◊ |
L |
x,-y+1,-z+1/2 |
6_565 |
10 |
3 |
8888 |
96.0 |
-1.1 |
0.586 |
1 |
0 |
0 |
0.000 |
14 |
33 |
|
G |
6 |
3 |
6716 |
◊ |
K |
x,y-1,z |
1_545 |
7 |
4 |
5948 |
81.4 |
-0.6 |
0.519 |
1 |
2 |
0 |
0.000 |
15 |
34 |
|
E |
6 |
2 |
6196 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
6833 |
80.0 |
1.2 |
0.766 |
1 |
2 |
0 |
0.000 |
16 |
35 |
|
D |
7 |
3 |
6640 |
◊ |
B |
x,y-1,z |
1_545 |
7 |
3 |
5964 |
77.0 |
0.4 |
0.636 |
1 |
3 |
0 |
0.000 |
17 |
36 |
|
L |
11 |
5 |
8888 |
◊ |
C |
x,-y+1,-z+1/2 |
6_565 |
6 |
3 |
8724 |
67.4 |
1.2 |
0.848 |
2 |
0 |
0 |
0.000 |
37 |
|
L |
5 |
1 |
8888 |
◊ |
C |
x-1,-y+1,-z+1/2 |
6_465 |
5 |
1 |
8724 |
56.3 |
1.2 |
0.849 |
0 |
0 |
0 |
0.000 |
38 |
|
I |
5 |
1 |
8798 |
◊ |
F |
x-1,-y,-z+1/2 |
6_455 |
6 |
1 |
8892 |
54.5 |
1.3 |
0.885 |
0 |
0 |
0 |
0.000 |
39 |
|
I |
4 |
2 |
8798 |
◊ |
F |
x,-y,-z+1/2 |
6_555 |
2 |
1 |
8892 |
39.9 |
0.9 |
0.731 |
1 |
0 |
0 |
0.000 |
Average: |
54.5 |
1.1 |
0.828 |
1 |
0 |
0 |
0.000 |
18 |
40 |
|
L |
3 |
3 |
8888 |
◊ |
C |
x,y,z |
1_555 |
6 |
3 |
8724 |
45.6 |
-0.6 |
0.462 |
0 |
0 |
0 |
0.000 |
41 |
|
L |
8 |
2 |
8888 |
◊ |
C |
x-1,y,z |
1_455 |
2 |
2 |
8724 |
39.4 |
-1.0 |
0.210 |
0 |
0 |
0 |
0.000 |
42 |
|
I |
6 |
2 |
8798 |
◊ |
F |
x-1,y,z |
1_455 |
2 |
2 |
8892 |
38.5 |
-0.8 |
0.222 |
0 |
0 |
0 |
0.000 |
Average: |
41.2 |
-0.8 |
0.298 |
0 |
0 |
0 |
0.000 |
19 |
43 |
|
E |
4 |
2 |
6196 |
◊ |
D |
-y+1,-x+1,-z+1/4 |
8_665 |
6 |
2 |
6640 |
39.4 |
-1.1 |
0.323 |
0 |
0 |
0 |
0.000 |
20 |
44 |
|
L |
4 |
3 |
8888 |
◊ |
F |
x-1,y+1,z |
1_465 |
2 |
2 |
8892 |
37.6 |
0.1 |
0.528 |
0 |
0 |
0 |
0.000 |
21 |
45 |
|
H |
3 |
1 |
6094 |
◊ |
E |
x-1,y,z |
1_455 |
2 |
1 |
6196 |
35.9 |
1.2 |
0.917 |
2 |
3 |
0 |
0.000 |
46 |
|
K |
3 |
1 |
5948 |
◊ |
B |
x-1,y,z |
1_455 |
2 |
1 |
5964 |
34.9 |
1.1 |
0.914 |
1 |
2 |
0 |
0.000 |
Average: |
35.4 |
1.1 |
0.916 |
2 |
3 |
0 |
0.000 |
22 |
47 |
|
[9BK]L:301 |
2 |
1 |
814 |
◊ |
C |
x-1,-y+1,-z+1/2 |
6_465 |
5 |
1 |
8724 |
35.6 |
-0.0 |
0.584 |
0 |
0 |
0 |
0.000 |
48 |
|
[9BK]I:301 |
1 |
1 |
817 |
◊ |
F |
x-1,-y,-z+1/2 |
6_455 |
4 |
1 |
8892 |
32.1 |
-0.2 |
0.430 |
0 |
0 |
0 |
0.000 |
49 |
|
[9BK]F:301 |
3 |
1 |
817 |
◊ |
I |
x,-y,-z+1/2 |
6_555 |
3 |
2 |
8798 |
31.2 |
-0.7 |
0.398 |
0 |
0 |
0 |
0.000 |
Average: |
33.0 |
-0.3 |
0.471 |
0 |
0 |
0 |
0.000 |
23 |
50 |
|
[9BK]C:301 |
3 |
1 |
816 |
◊ |
L |
x,y,z |
1_555 |
3 |
2 |
8888 |
35.5 |
-1.1 |
0.314 |
0 |
0 |
0 |
0.000 |
51 |
|
[9BK]F:301 |
1 |
1 |
817 |
◊ |
I |
x,y,z |
1_555 |
1 |
1 |
8798 |
1.5 |
-0.0 |
0.618 |
0 |
0 |
0 |
0.000 |
Average: |
18.5 |
-0.6 |
0.466 |
0 |
0 |
0 |
0.000 |
24 |
52 |
|
[9BK]L:301 |
3 |
1 |
814 |
◊ |
C |
x-1,y,z |
1_455 |
8 |
3 |
8724 |
35.4 |
-1.1 |
0.488 |
0 |
0 |
0 |
0.000 |
53 |
|
[9BK]I:301 |
2 |
1 |
817 |
◊ |
F |
x-1,y,z |
1_455 |
6 |
3 |
8892 |
30.1 |
-0.9 |
0.424 |
0 |
0 |
0 |
0.000 |
Average: |
32.7 |
-1.0 |
0.456 |
0 |
0 |
0 |
0.000 |
25 |
54 |
|
F |
2 |
1 |
8892 |
◊ |
B |
x,y-1,z |
1_545 |
2 |
1 |
5964 |
26.7 |
0.9 |
0.873 |
0 |
0 |
0 |
0.000 |
26 |
55 |
|
J |
6 |
3 |
6695 |
◊ |
H |
-y,-x+1,-z+1/4 |
8_565 |
3 |
3 |
6094 |
25.0 |
0.0 |
0.674 |
0 |
0 |
0 |
0.000 |
56 |
|
K |
3 |
3 |
5948 |
◊ |
A |
-y+1,-x+1,-z+1/4 |
8_665 |
5 |
3 |
6833 |
21.5 |
-0.0 |
0.630 |
0 |
0 |
0 |
0.000 |
Average: |
23.2 |
-0.0 |
0.652 |
0 |
0 |
0 |
0.000 |
27 |
57 |
|
D |
3 |
3 |
6640 |
◊ |
D |
-y+1,-x+1,-z+1/4 |
8_665 |
3 |
3 |
6640 |
12.1 |
-0.1 |
0.615 |
0 |
0 |
0 |
0.000 |
28 |
58 |
|
K |
1 |
1 |
5948 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
5964 |
12.0 |
0.4 |
0.829 |
0 |
0 |
0 |
0.000 |
59 |
|
H |
1 |
1 |
6094 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
6196 |
6.7 |
0.3 |
0.848 |
0 |
0 |
0 |
0.000 |
Average: |
9.3 |
0.3 |
0.839 |
0 |
0 |
0 |
0.000 |
29 |
60 |
|
D |
2 |
2 |
6640 |
◊ |
A |
-y+1,-x+1,-z+1/4 |
8_665 |
4 |
2 |
6833 |
10.0 |
0.2 |
0.739 |
0 |
0 |
0 |
0.000 |
30 |
61 |
|
I |
1 |
1 |
8798 |
◊ |
C |
x,y-1,z |
1_545 |
1 |
1 |
8724 |
4.0 |
-0.0 |
0.561 |
0 |
0 |
0 |
0.000 |
31 |
62 |
|
I |
1 |
1 |
8798 |
◊ |
C |
x-1,y,z |
1_455 |
1 |
1 |
8724 |
0.9 |
0.0 |
0.709 |
0 |
0 |
0 |
0.000 |
|