## |
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 |
|
C |
49 |
6 |
4577 |
◊ |
D |
x,y-1,z |
1_545 |
46 |
7 |
4531 |
320.3 |
-4.5 |
0.843 |
2 |
0 |
0 |
0.000 |
2 |
|
B |
44 |
6 |
4455 |
◊ |
A |
x,y-1,z |
1_545 |
43 |
5 |
4476 |
296.5 |
-3.1 |
0.864 |
1 |
0 |
0 |
0.000 |
3 |
|
B |
45 |
6 |
4455 |
◊ |
A |
x,y,z |
1_555 |
43 |
8 |
4476 |
288.4 |
-2.3 |
0.891 |
1 |
0 |
0 |
0.000 |
4 |
|
D |
42 |
6 |
4531 |
◊ |
C |
x,y,z |
1_555 |
43 |
5 |
4577 |
281.5 |
-4.4 |
0.818 |
3 |
0 |
0 |
0.000 |
Average: |
296.7 |
-3.6 |
0.854 |
2 |
0 |
0 |
0.000 |
2 |
5 |
|
B |
32 |
3 |
4455 |
x |
B |
x-1,y,z |
1_455 |
36 |
5 |
4455 |
263.4 |
-6.1 |
0.706 |
2 |
0 |
0 |
0.000 |
6 |
|
A |
34 |
5 |
4476 |
x |
A |
x-1,y,z |
1_455 |
30 |
2 |
4476 |
259.1 |
-4.3 |
0.731 |
2 |
0 |
0 |
0.000 |
Average: |
261.2 |
-5.2 |
0.719 |
2 |
0 |
0 |
0.000 |
3 |
7 |
|
C |
30 |
7 |
4577 |
x |
C |
x-1,y,z |
1_455 |
24 |
3 |
4577 |
161.3 |
-4.7 |
0.641 |
0 |
0 |
0 |
0.000 |
8 |
|
D |
16 |
2 |
4531 |
x |
D |
x-1,y,z |
1_455 |
13 |
2 |
4531 |
103.9 |
1.2 |
0.855 |
0 |
0 |
0 |
0.000 |
Average: |
132.6 |
-1.8 |
0.748 |
0 |
0 |
0 |
0.000 |
4 |
9 |
|
[K]D:104 |
1 |
1 |
216 |
f |
D |
x,y,z |
1_555 |
23 |
7 |
4531 |
122.9 |
-74.5 |
0.000 |
0 |
0 |
0 |
0.104 |
10 |
|
[K]C:104 |
1 |
1 |
216 |
f |
C |
x,y,z |
1_555 |
19 |
6 |
4577 |
108.5 |
-69.7 |
0.000 |
0 |
0 |
0 |
0.104 |
Average: |
115.7 |
-72.1 |
0.000 |
0 |
0 |
0 |
0.104 |
5 |
11 |
|
C |
15 |
1 |
4577 |
◊ |
B |
x-1,y,z |
1_455 |
12 |
2 |
4455 |
104.5 |
-1.9 |
0.644 |
1 |
0 |
0 |
0.000 |
12 |
|
D |
15 |
1 |
4531 |
◊ |
A |
x,y,z-1 |
1_554 |
12 |
1 |
4476 |
93.2 |
0.2 |
0.795 |
0 |
0 |
0 |
0.000 |
Average: |
98.9 |
-0.9 |
0.720 |
1 |
0 |
0 |
0.000 |
6 |
13 |
|
C |
11 |
1 |
4577 |
◊ |
B |
x-1,y,z-1 |
1_454 |
14 |
2 |
4455 |
103.1 |
-0.0 |
0.768 |
0 |
0 |
0 |
0.005 |
14 |
|
D |
12 |
2 |
4531 |
◊ |
A |
x,y,z |
1_555 |
12 |
1 |
4476 |
101.8 |
-3.4 |
0.481 |
1 |
0 |
0 |
0.005 |
Average: |
102.5 |
-1.7 |
0.625 |
1 |
0 |
0 |
0.005 |
7 |
15 |
|
[K]C:101 |
1 |
1 |
216 |
f |
C |
x,y,z |
1_555 |
6 |
4 |
4577 |
82.5 |
-79.9 |
0.000 |
0 |
0 |
0 |
0.220 |
16 |
|
[K]B:101 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
4 |
4 |
4455 |
80.9 |
-79.3 |
0.000 |
0 |
0 |
0 |
0.220 |
17 |
|
[K]A:101 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
4 |
4 |
4476 |
80.3 |
-79.2 |
0.000 |
0 |
0 |
0 |
0.220 |
18 |
|
[K]D:101 |
1 |
1 |
216 |
f |
D |
x,y,z |
1_555 |
4 |
4 |
4531 |
78.7 |
-77.8 |
0.000 |
0 |
0 |
0 |
0.220 |
Average: |
80.6 |
-79.0 |
0.000 |
0 |
0 |
0 |
0.220 |
8 |
19 |
|
[K]A:102 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
4476 |
79.6 |
-79.5 |
0.000 |
0 |
0 |
0 |
0.222 |
20 |
|
[K]D:102 |
1 |
1 |
216 |
f |
D |
x,y,z |
1_555 |
3 |
3 |
4531 |
78.9 |
-78.6 |
0.000 |
0 |
0 |
0 |
0.222 |
Average: |
79.3 |
-79.0 |
0.000 |
0 |
0 |
0 |
0.222 |
9 |
21 |
|
[K]A:104 |
1 |
1 |
216 |
f |
D |
x,y,z |
1_555 |
16 |
3 |
4531 |
73.1 |
-39.4 |
0.000 |
0 |
0 |
0 |
0.055 |
10 |
22 |
|
[K]A:104 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
8 |
2 |
4476 |
67.6 |
-36.3 |
0.000 |
0 |
0 |
0 |
0.051 |
11 |
23 |
|
C |
13 |
3 |
4577 |
◊ |
[K]D:104 |
x,y-1,z |
1_545 |
1 |
1 |
216 |
65.8 |
-35.2 |
0.000 |
0 |
0 |
0 |
0.000 |
24 |
|
[K]C:104 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
11 |
3 |
4531 |
60.7 |
-31.7 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
63.3 |
-33.5 |
0.000 |
0 |
0 |
0 |
0.000 |
12 |
25 |
|
D |
7 |
1 |
4531 |
◊ |
A |
x-1,y,z |
1_455 |
7 |
2 |
4476 |
65.2 |
-1.8 |
0.490 |
0 |
0 |
0 |
0.000 |
26 |
|
C |
1 |
1 |
4577 |
◊ |
B |
x,y,z-1 |
1_554 |
3 |
1 |
4455 |
20.1 |
-0.8 |
0.384 |
0 |
0 |
0 |
0.000 |
Average: |
42.6 |
-1.3 |
0.437 |
0 |
0 |
0 |
0.000 |
13 |
27 |
|
[K]B:103 |
1 |
1 |
216 |
f |
[K]B:102 |
x,y,z |
1_555 |
1 |
1 |
216 |
63.1 |
-63.1 |
0.000 |
0 |
0 |
0 |
0.030 |
14 |
28 |
|
[K]C:103 |
1 |
1 |
216 |
f |
[K]C:102 |
x,y,z |
1_555 |
1 |
1 |
216 |
61.6 |
-61.6 |
0.000 |
0 |
0 |
0 |
0.022 |
15 |
29 |
|
[K]D:103 |
1 |
1 |
216 |
f |
[K]D:101 |
x,y,z |
1_555 |
1 |
1 |
216 |
55.9 |
-55.9 |
0.000 |
0 |
0 |
0 |
0.078 |
16 |
30 |
|
[K]D:103 |
1 |
1 |
216 |
f |
[K]D:102 |
x,y,z |
1_555 |
1 |
1 |
216 |
54.7 |
-54.7 |
0.000 |
0 |
0 |
0 |
0.077 |
17 |
31 |
|
[K]B:103 |
1 |
1 |
216 |
f |
[K]B:101 |
x,y,z |
1_555 |
1 |
1 |
216 |
54.3 |
-54.3 |
0.000 |
0 |
0 |
0 |
0.026 |
18 |
32 |
|
[K]A:103 |
1 |
1 |
216 |
f |
[K]A:101 |
x,y,z |
1_555 |
1 |
1 |
216 |
54.1 |
-54.1 |
0.000 |
0 |
0 |
0 |
0.076 |
19 |
33 |
|
[K]A:103 |
1 |
1 |
216 |
f |
[K]A:102 |
x,y,z |
1_555 |
1 |
1 |
216 |
53.8 |
-53.8 |
0.000 |
0 |
0 |
0 |
0.075 |
20 |
34 |
|
[K]C:103 |
1 |
1 |
216 |
f |
[K]C:101 |
x,y,z |
1_555 |
1 |
1 |
216 |
53.7 |
-53.7 |
0.000 |
0 |
0 |
0 |
0.019 |
21 |
35 |
|
C |
3 |
1 |
4577 |
◊ |
A |
x-1,y,z |
1_455 |
4 |
1 |
4476 |
21.7 |
-1.1 |
0.426 |
0 |
0 |
0 |
0.000 |
36 |
|
B |
4 |
1 |
4455 |
◊ |
D |
x,y-1,z+1 |
1_546 |
2 |
1 |
4531 |
2.8 |
0.0 |
0.494 |
0 |
0 |
0 |
0.000 |
Average: |
12.2 |
-0.6 |
0.460 |
0 |
0 |
0 |
0.000 |
22 |
37 |
|
C |
6 |
1 |
4577 |
◊ |
D |
x-1,y-1,z |
1_445 |
1 |
1 |
4531 |
19.1 |
0.5 |
0.563 |
0 |
0 |
0 |
0.000 |
38 |
|
C |
1 |
1 |
4577 |
◊ |
D |
x-1,y,z |
1_455 |
1 |
1 |
4531 |
2.4 |
-0.1 |
0.360 |
0 |
0 |
0 |
0.000 |
Average: |
10.7 |
0.2 |
0.462 |
0 |
0 |
0 |
0.000 |
23 |
39 |
|
C |
3 |
1 |
4577 |
◊ |
[K]C:104 |
x-1,y,z |
1_455 |
1 |
1 |
216 |
18.9 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.000 |
40 |
|
[K]D:104 |
1 |
1 |
216 |
◊ |
D |
x-1,y,z |
1_455 |
1 |
1 |
4531 |
1.2 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
10.1 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.000 |
24 |
41 |
|
[K]B:102 |
1 |
1 |
216 |
f |
[K]B:101 |
x,y,z |
1_555 |
1 |
1 |
216 |
14.2 |
-14.2 |
0.000 |
0 |
0 |
0 |
0.007 |
25 |
42 |
|
[K]D:102 |
1 |
1 |
216 |
f |
[K]D:101 |
x,y,z |
1_555 |
1 |
1 |
216 |
13.9 |
-13.9 |
0.000 |
0 |
0 |
0 |
0.019 |
26 |
43 |
|
[K]C:102 |
1 |
1 |
216 |
f |
[K]C:101 |
x,y,z |
1_555 |
1 |
1 |
216 |
12.9 |
-12.9 |
0.000 |
0 |
0 |
0 |
0.005 |
27 |
44 |
|
[K]A:102 |
1 |
1 |
216 |
f |
[K]A:101 |
x,y,z |
1_555 |
1 |
1 |
216 |
12.0 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.017 |
28 |
45 |
|
C |
2 |
2 |
4577 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
4455 |
11.4 |
-1.2 |
0.382 |
0 |
0 |
0 |
0.000 |
46 |
|
D |
2 |
2 |
4531 |
◊ |
A |
x-1,y,z-1 |
1_454 |
4 |
2 |
4476 |
9.8 |
-0.9 |
0.391 |
0 |
0 |
0 |
0.000 |
Average: |
10.6 |
-1.1 |
0.387 |
0 |
0 |
0 |
0.000 |
|