## |
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 |
|
A |
211 |
49 |
18146 |
◊ |
A |
-x+1,y,-z |
2_655 |
212 |
49 |
18146 |
2151.2 |
-17.0 |
0.153 |
29 |
16 |
1 |
1.000 |
2 |
|
B |
217 |
53 |
18224 |
◊ |
B |
-x,y,-z+1 |
2_556 |
216 |
53 |
18224 |
2141.8 |
-16.3 |
0.176 |
35 |
16 |
1 |
1.000 |
Average: |
2146.5 |
-16.7 |
0.165 |
32 |
16 |
1 |
1.000 |
2 |
3 |
|
P |
70 |
13 |
1745 |
◊ |
A |
x,y,z |
1_555 |
111 |
32 |
18146 |
834.5 |
-7.5 |
0.459 |
10 |
4 |
0 |
1.000 |
4 |
|
Q |
71 |
13 |
1720 |
◊ |
B |
x,y,z |
1_555 |
112 |
33 |
18224 |
828.1 |
-7.0 |
0.506 |
11 |
4 |
0 |
1.000 |
Average: |
831.3 |
-7.2 |
0.483 |
11 |
4 |
0 |
1.000 |
3 |
5 |
|
B |
61 |
21 |
18224 |
◊ |
A |
x,y,z |
1_555 |
46 |
11 |
18146 |
482.9 |
-4.6 |
0.269 |
2 |
0 |
0 |
0.000 |
6 |
|
B |
46 |
11 |
18224 |
◊ |
A |
x-1,y,z |
1_455 |
54 |
19 |
18146 |
468.5 |
-4.6 |
0.251 |
1 |
0 |
0 |
0.000 |
Average: |
475.7 |
-4.6 |
0.260 |
2 |
0 |
0 |
0.000 |
4 |
7 |
|
B |
57 |
17 |
18224 |
◊ |
A |
x-1/2,y+1/2,z |
3_455 |
54 |
16 |
18146 |
448.6 |
-5.0 |
0.259 |
0 |
0 |
0 |
0.000 |
5 |
8 |
|
P |
22 |
7 |
1745 |
◊ |
B |
x,y,z |
1_555 |
44 |
13 |
18224 |
320.6 |
-1.7 |
0.515 |
3 |
0 |
0 |
0.181 |
9 |
|
Q |
23 |
7 |
1720 |
◊ |
A |
x-1,y,z |
1_455 |
41 |
13 |
18146 |
310.8 |
-2.5 |
0.478 |
2 |
0 |
0 |
0.181 |
Average: |
315.7 |
-2.1 |
0.496 |
3 |
0 |
0 |
0.181 |
6 |
10 |
|
B |
26 |
7 |
18224 |
◊ |
A |
x-1/2,y-1/2,z |
3_445 |
26 |
7 |
18146 |
218.5 |
0.1 |
0.659 |
0 |
2 |
0 |
0.000 |
7 |
11 |
|
[PXY]Q:101 |
8 |
1 |
275 |
cf |
Q |
x,y,z |
1_555 |
17 |
5 |
1720 |
118.1 |
1.8 |
0.051 |
0 |
0 |
0 |
0.000 |
8 |
12 |
|
[PXY]P:101 |
8 |
1 |
275 |
cf |
P |
x,y,z |
1_555 |
16 |
5 |
1745 |
117.3 |
1.4 |
0.044 |
0 |
0 |
0 |
0.000 |
9 |
13 |
|
[ACE]P:1 |
3 |
1 |
171 |
cf |
P |
x,y,z |
1_555 |
8 |
4 |
1745 |
66.9 |
-0.4 |
0.779 |
1 |
0 |
0 |
0.083 |
10 |
14 |
|
[ACE]Q:1 |
3 |
1 |
172 |
cf |
Q |
x,y,z |
1_555 |
8 |
4 |
1720 |
66.3 |
-0.3 |
0.786 |
2 |
0 |
0 |
0.113 |
11 |
15 |
|
[PXY]Q:101 |
4 |
1 |
275 |
◊ |
A |
x-1,y,z |
1_455 |
8 |
3 |
18146 |
63.2 |
1.8 |
0.122 |
0 |
0 |
0 |
0.000 |
12 |
16 |
|
[PXY]P:101 |
4 |
1 |
275 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
18224 |
61.8 |
1.8 |
0.121 |
0 |
0 |
0 |
0.000 |
13 |
17 |
|
[PXY]Q:101 |
7 |
1 |
275 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
18224 |
59.0 |
1.4 |
0.005 |
0 |
0 |
0 |
0.000 |
14 |
18 |
|
[PXY]P:101 |
7 |
1 |
275 |
◊ |
A |
x,y,z |
1_555 |
10 |
3 |
18146 |
58.9 |
1.5 |
0.005 |
0 |
0 |
0 |
0.000 |
15 |
19 |
|
[NH2]P:16 |
1 |
1 |
117 |
cf |
P |
x,y,z |
1_555 |
9 |
4 |
1745 |
50.0 |
0.4 |
0.756 |
0 |
0 |
0 |
0.000 |
16 |
20 |
|
[NH2]Q:16 |
1 |
1 |
117 |
◊ |
A |
x-1,y,z |
1_455 |
9 |
3 |
18146 |
44.4 |
0.5 |
0.727 |
0 |
0 |
0 |
0.000 |
17 |
21 |
|
[NH2]Q:16 |
1 |
1 |
117 |
cf |
Q |
x,y,z |
1_555 |
4 |
1 |
1720 |
44.2 |
0.0 |
0.612 |
0 |
0 |
0 |
0.000 |
18 |
22 |
|
[NH2]P:16 |
1 |
1 |
117 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
18224 |
35.4 |
0.2 |
0.662 |
0 |
0 |
0 |
0.000 |
19 |
23 |
|
[ACE]Q:1 |
1 |
1 |
172 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
18224 |
32.4 |
-0.7 |
0.580 |
0 |
0 |
0 |
0.064 |
20 |
24 |
|
[ACE]P:1 |
2 |
1 |
171 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
18224 |
32.3 |
-0.5 |
0.756 |
0 |
0 |
0 |
0.028 |
21 |
25 |
|
[ACE]Q:1 |
2 |
1 |
172 |
◊ |
A |
x-1,y,z |
1_455 |
6 |
2 |
18146 |
31.9 |
-0.6 |
0.641 |
0 |
0 |
0 |
0.030 |
22 |
26 |
|
[ACE]P:1 |
1 |
1 |
171 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
18146 |
30.2 |
-0.5 |
0.632 |
0 |
0 |
0 |
0.054 |
23 |
27 |
|
[PXY]P:101 |
7 |
1 |
275 |
f |
[NH2]P:16 |
x,y,z |
1_555 |
1 |
1 |
117 |
15.3 |
0.7 |
1.000 |
0 |
0 |
0 |
0.000 |
24 |
28 |
|
[PXY]Q:101 |
2 |
1 |
275 |
f |
[NH2]Q:16 |
x,y,z |
1_555 |
1 |
1 |
117 |
9.5 |
0.4 |
0.250 |
0 |
0 |
0 |
0.000 |
25 |
29 |
|
[PXY]Q:101 |
1 |
1 |
275 |
f |
[ACE]Q:1 |
x,y,z |
1_555 |
2 |
1 |
172 |
8.6 |
0.1 |
0.471 |
0 |
0 |
0 |
0.000 |
26 |
30 |
|
[PXY]P:101 |
1 |
1 |
275 |
f |
[ACE]P:1 |
x,y,z |
1_555 |
1 |
1 |
171 |
7.6 |
0.1 |
0.408 |
0 |
0 |
0 |
0.000 |
|