## |
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 |
116 |
31 |
10526 |
◊ |
C |
x,y,z |
1_555 |
115 |
31 |
10230 |
1124.2 |
-6.8 |
0.318 |
21 |
0 |
0 |
0.259 |
2 |
|
B |
112 |
29 |
10257 |
◊ |
A |
x,y,z |
1_555 |
115 |
29 |
10373 |
1044.1 |
-9.5 |
0.122 |
19 |
0 |
0 |
0.259 |
Average: |
1084.1 |
-8.2 |
0.220 |
20 |
0 |
0 |
0.259 |
2 |
3 |
|
D |
102 |
34 |
10526 |
◊ |
A |
x,y,z |
1_555 |
106 |
35 |
10373 |
954.8 |
-9.1 |
0.108 |
10 |
4 |
0 |
0.204 |
4 |
|
C |
90 |
32 |
10230 |
◊ |
B |
x,y,z |
1_555 |
89 |
32 |
10257 |
852.7 |
-8.4 |
0.144 |
8 |
4 |
0 |
0.204 |
Average: |
903.8 |
-8.8 |
0.126 |
9 |
4 |
0 |
0.204 |
3 |
5 |
|
B |
48 |
16 |
10257 |
◊ |
A |
x-1,y,z |
1_455 |
50 |
15 |
10373 |
409.9 |
2.1 |
0.785 |
8 |
2 |
0 |
0.000 |
4 |
6 |
|
C |
43 |
16 |
10230 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
41 |
14 |
10373 |
351.5 |
1.8 |
0.790 |
6 |
0 |
0 |
0.000 |
5 |
7 |
|
D |
27 |
7 |
10526 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
37 |
12 |
10373 |
285.8 |
2.2 |
0.769 |
2 |
0 |
0 |
0.000 |
6 |
8 |
|
[XMM]A:242 |
22 |
1 |
493 |
◊ |
A |
x,y,z |
1_555 |
26 |
11 |
10373 |
209.7 |
0.5 |
0.492 |
8 |
0 |
0 |
0.000 |
9 |
|
[XMM]B:242 |
21 |
1 |
492 |
◊ |
B |
x,y,z |
1_555 |
27 |
11 |
10257 |
204.0 |
1.0 |
0.530 |
8 |
0 |
0 |
0.000 |
Average: |
206.8 |
0.7 |
0.511 |
8 |
0 |
0 |
0.000 |
7 |
10 |
|
[XMM]D:242 |
20 |
1 |
496 |
◊ |
D |
x,y,z |
1_555 |
26 |
11 |
10526 |
200.6 |
1.2 |
0.542 |
8 |
0 |
0 |
0.000 |
11 |
|
[XMM]C:242 |
17 |
1 |
501 |
◊ |
C |
x,y,z |
1_555 |
25 |
11 |
10230 |
193.9 |
1.2 |
0.590 |
8 |
0 |
0 |
0.000 |
Average: |
197.3 |
1.2 |
0.566 |
8 |
0 |
0 |
0.000 |
8 |
12 |
|
B |
28 |
9 |
10257 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
17 |
7 |
10373 |
176.9 |
-0.4 |
0.499 |
1 |
0 |
0 |
0.000 |
9 |
13 |
|
B |
17 |
7 |
10257 |
f |
[XMM]A:242 |
-x,y-1/2,-z-1/2 |
3_544 |
9 |
1 |
493 |
130.6 |
-2.7 |
0.399 |
1 |
0 |
0 |
0.046 |
10 |
14 |
|
[XMM]D:242 |
8 |
1 |
496 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
12 |
4 |
10373 |
83.0 |
-0.4 |
0.522 |
0 |
0 |
0 |
0.000 |
11 |
15 |
|
D |
9 |
4 |
10526 |
◊ |
C |
x-1/2,-y-3/2,-z |
4_435 |
10 |
4 |
10230 |
82.4 |
1.0 |
0.775 |
0 |
0 |
0 |
0.000 |
12 |
16 |
|
[MN]A:241 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
9 |
8 |
10373 |
60.3 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.207 |
17 |
|
[MN]B:241 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
10 |
8 |
10257 |
60.1 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.207 |
18 |
|
[MN]D:241 |
1 |
1 |
123 |
f |
D |
x,y,z |
1_555 |
12 |
8 |
10526 |
59.6 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.207 |
19 |
|
[MN]C:241 |
1 |
1 |
123 |
f |
C |
x,y,z |
1_555 |
12 |
8 |
10230 |
58.6 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.207 |
Average: |
59.7 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.207 |
13 |
20 |
|
[XMM]C:242 |
6 |
1 |
501 |
◊ |
A |
x,y-1,z |
1_545 |
6 |
1 |
10373 |
54.7 |
-0.4 |
0.504 |
0 |
0 |
0 |
0.000 |
14 |
21 |
|
[MN]B:243 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
10257 |
53.4 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.125 |
22 |
|
[MN]D:243 |
1 |
1 |
123 |
f |
D |
x,y,z |
1_555 |
7 |
3 |
10526 |
53.1 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.125 |
23 |
|
[MN]A:243 |
1 |
1 |
123 |
cf |
A |
x,y,z |
1_555 |
7 |
3 |
10373 |
50.9 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.125 |
24 |
|
[MN]C:243 |
1 |
1 |
123 |
f |
C |
x,y,z |
1_555 |
6 |
2 |
10230 |
47.6 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.125 |
Average: |
51.3 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.125 |
15 |
25 |
|
[MN]C:243 |
1 |
1 |
123 |
◊ |
B |
x,y,z |
1_555 |
9 |
5 |
10257 |
51.0 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.085 |
26 |
|
[MN]A:243 |
1 |
1 |
123 |
◊ |
D |
x,y,z |
1_555 |
8 |
4 |
10526 |
47.4 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.085 |
27 |
|
[MN]B:243 |
1 |
1 |
123 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
10230 |
43.6 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.085 |
28 |
|
[MN]D:243 |
1 |
1 |
123 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
10373 |
41.9 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.085 |
Average: |
46.0 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.085 |
16 |
29 |
|
[XMM]D:242 |
7 |
1 |
496 |
◊ |
[XMM]C:242 |
x-1/2,-y-3/2,-z |
4_435 |
4 |
1 |
501 |
46.7 |
-0.6 |
0.403 |
0 |
0 |
0 |
0.000 |
17 |
30 |
|
[CA]B:240 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
13 |
8 |
10257 |
42.3 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.335 |
31 |
|
[CA]D:240 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
9 |
6 |
10526 |
42.0 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.335 |
32 |
|
[CA]C:240 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
11 |
7 |
10230 |
41.2 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.335 |
33 |
|
[CA]A:240 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
10 |
7 |
10373 |
40.5 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.335 |
Average: |
41.5 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.335 |
18 |
34 |
|
C |
3 |
1 |
10230 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
10373 |
31.8 |
0.6 |
0.808 |
0 |
0 |
0 |
0.000 |
35 |
|
D |
4 |
2 |
10526 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
10257 |
26.1 |
-0.4 |
0.270 |
0 |
0 |
0 |
0.000 |
Average: |
29.0 |
0.1 |
0.539 |
0 |
0 |
0 |
0.000 |
19 |
36 |
|
D |
2 |
1 |
10526 |
f |
[XMM]C:242 |
x-1/2,-y-3/2,-z |
4_435 |
2 |
1 |
501 |
30.3 |
-1.1 |
0.148 |
0 |
0 |
0 |
0.017 |
37 |
|
[XMM]D:242 |
1 |
1 |
496 |
f |
C |
x-1/2,-y-3/2,-z |
4_435 |
1 |
1 |
10230 |
2.7 |
-0.0 |
0.396 |
0 |
0 |
0 |
0.017 |
Average: |
16.5 |
-0.6 |
0.272 |
0 |
0 |
0 |
0.017 |
20 |
38 |
|
C |
2 |
1 |
10230 |
◊ |
B |
-x,y-1/2,-z-1/2 |
3_544 |
3 |
1 |
10257 |
15.0 |
-0.1 |
0.415 |
0 |
0 |
0 |
0.000 |
21 |
39 |
|
[MN]A:241 |
1 |
1 |
123 |
f |
[CA]A:240 |
x,y,z |
1_555 |
1 |
1 |
85 |
12.2 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.035 |
22 |
40 |
|
[MN]D:241 |
1 |
1 |
123 |
f |
[CA]D:240 |
x,y,z |
1_555 |
1 |
1 |
85 |
12.1 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.038 |
23 |
41 |
|
[MN]C:241 |
1 |
1 |
123 |
f |
[CA]C:240 |
x,y,z |
1_555 |
1 |
1 |
85 |
12.1 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.037 |
24 |
42 |
|
[MN]B:241 |
1 |
1 |
123 |
f |
[CA]B:240 |
x,y,z |
1_555 |
1 |
1 |
85 |
11.4 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.033 |
25 |
43 |
|
C |
1 |
1 |
10230 |
f |
[XMM]B:242 |
-x-1,y-1/2,-z-1/2 |
3_444 |
1 |
1 |
492 |
3.1 |
0.1 |
0.599 |
0 |
0 |
0 |
0.000 |
26 |
44 |
|
[XMM]B:242 |
1 |
1 |
492 |
◊ |
[CA]B:240 |
x,y,z |
1_555 |
1 |
1 |
85 |
0.7 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
45 |
|
[XMM]C:242 |
1 |
1 |
501 |
◊ |
[CA]C:240 |
x,y,z |
1_555 |
1 |
1 |
85 |
0.1 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
0.4 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
27 |
46 |
|
C |
1 |
1 |
10230 |
◊ |
B |
-x-1,y-1/2,-z-1/2 |
3_444 |
1 |
1 |
10257 |
0.4 |
-0.0 |
0.607 |
0 |
0 |
0 |
0.000 |
|