| ## |
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 |
338 |
79 |
12707 |
◊ |
C |
x,y,z |
1_555 |
274 |
58 |
6581 |
2881.0 |
-37.0 |
0.306 |
50 |
3 |
0 |
1.000 |
2 |
|
B |
337 |
80 |
12717 |
◊ |
A |
x,y,z |
1_555 |
275 |
58 |
6588 |
2873.9 |
-37.0 |
0.308 |
51 |
3 |
0 |
1.000 |
| Average: |
2877.4 |
-37.0 |
0.307 |
51 |
3 |
0 |
1.000 |
| 2 |
3 |
|
A |
53 |
15 |
6588 |
x |
A |
-y+1,x-y,z |
2_655 |
56 |
17 |
6588 |
471.4 |
-5.4 |
0.585 |
5 |
0 |
0 |
1.000 |
4 |
|
C |
55 |
17 |
6581 |
x |
C |
-y+1,x-y,z |
2_655 |
51 |
15 |
6581 |
468.4 |
-5.3 |
0.586 |
5 |
0 |
0 |
1.000 |
| Average: |
469.9 |
-5.3 |
0.586 |
5 |
0 |
0 |
1.000 |
| 3 |
5 |
|
D |
55 |
20 |
12707 |
◊ |
C |
-y+1,x-y,z |
2_655 |
47 |
14 |
6581 |
445.0 |
-2.1 |
0.602 |
8 |
3 |
0 |
0.089 |
6 |
|
A |
47 |
14 |
6588 |
◊ |
B |
-y+1,x-y,z |
2_655 |
56 |
19 |
12717 |
444.2 |
-2.4 |
0.601 |
9 |
2 |
0 |
0.089 |
| Average: |
444.6 |
-2.2 |
0.601 |
9 |
3 |
0 |
0.089 |
| 4 |
7 |
|
B |
33 |
9 |
12717 |
x |
B |
-y+1,x-y,z |
2_655 |
44 |
15 |
12717 |
329.0 |
-0.8 |
0.643 |
4 |
2 |
0 |
0.039 |
8 |
|
D |
45 |
15 |
12707 |
x |
D |
-y+1,x-y,z |
2_655 |
35 |
9 |
12707 |
325.1 |
-0.8 |
0.659 |
3 |
2 |
0 |
0.039 |
| Average: |
327.0 |
-0.8 |
0.651 |
4 |
2 |
0 |
0.039 |
| 5 |
9 |
|
B |
36 |
8 |
12717 |
◊ |
D |
-x+y+2/3,-x+4/3,z+1/3 |
9_565 |
32 |
14 |
12707 |
301.7 |
0.3 |
0.832 |
0 |
0 |
0 |
0.000 |
| 6 |
10 |
|
D |
25 |
10 |
12707 |
◊ |
D |
y+1/3,x-1/3,-z-1/3 |
16_544 |
25 |
10 |
12707 |
229.7 |
-1.1 |
0.652 |
2 |
0 |
0 |
0.000 |
| 7 |
11 |
|
D |
20 |
6 |
12707 |
◊ |
B |
x,y,z |
1_555 |
20 |
6 |
12717 |
193.2 |
1.8 |
0.906 |
6 |
4 |
0 |
0.010 |
| 8 |
12 |
|
B |
21 |
5 |
12717 |
◊ |
B |
x-y+2/3,-y+4/3,-z+1/3 |
11_565 |
21 |
5 |
12717 |
159.8 |
-1.4 |
0.576 |
0 |
0 |
0 |
0.000 |
| 9 |
13 |
|
D |
11 |
5 |
12707 |
◊ |
A |
x,y,z |
1_555 |
21 |
9 |
6588 |
146.8 |
-2.1 |
0.258 |
0 |
0 |
0 |
0.026 |
14 |
|
B |
11 |
5 |
12717 |
◊ |
C |
x,y,z |
1_555 |
18 |
8 |
6581 |
141.3 |
-2.0 |
0.268 |
0 |
0 |
0 |
0.026 |
| Average: |
144.0 |
-2.0 |
0.263 |
0 |
0 |
0 |
0.026 |
| 10 |
15 |
|
B |
12 |
3 |
12717 |
◊ |
B |
x-y+1/3,-y+2/3,-z+2/3 |
17_555 |
12 |
3 |
12717 |
128.7 |
0.2 |
0.751 |
2 |
0 |
0 |
0.000 |
| 11 |
16 |
|
D |
15 |
6 |
12707 |
◊ |
B |
y,x,-z |
4_555 |
11 |
3 |
12717 |
118.6 |
1.1 |
0.824 |
1 |
3 |
0 |
0.000 |
| 12 |
17 |
|
C |
16 |
6 |
6581 |
◊ |
D |
-y+1,x-y,z |
2_655 |
15 |
5 |
12707 |
107.8 |
-2.5 |
0.268 |
1 |
0 |
0 |
0.040 |
18 |
|
B |
16 |
6 |
12717 |
◊ |
A |
-y+1,x-y,z |
2_655 |
15 |
6 |
6588 |
106.7 |
-2.5 |
0.273 |
1 |
0 |
0 |
0.040 |
| Average: |
107.2 |
-2.5 |
0.271 |
1 |
0 |
0 |
0.040 |
| 13 |
19 |
|
[PYR]B:82 |
5 |
1 |
204 |
cf |
B |
x,y,z |
1_555 |
12 |
5 |
12717 |
93.5 |
3.2 |
0.378 |
1 |
0 |
0 |
0.000 |
20 |
|
[PYR]D:82 |
5 |
1 |
205 |
cf |
D |
x,y,z |
1_555 |
13 |
5 |
12707 |
93.4 |
3.2 |
0.377 |
1 |
0 |
0 |
0.000 |
| Average: |
93.4 |
3.2 |
0.378 |
1 |
0 |
0 |
0.000 |
| 14 |
21 |
|
D |
9 |
4 |
12707 |
◊ |
C |
y,x,-z |
4_555 |
7 |
3 |
6581 |
65.5 |
-0.4 |
0.594 |
1 |
0 |
0 |
0.000 |
| 15 |
22 |
|
D |
8 |
3 |
12707 |
◊ |
D |
y,x,-z |
4_555 |
8 |
3 |
12707 |
45.9 |
-0.8 |
0.498 |
0 |
0 |
0 |
0.000 |
| 16 |
23 |
|
[PYR]D:82 |
3 |
1 |
205 |
◊ |
C |
x,y,z |
1_555 |
8 |
2 |
6581 |
37.6 |
1.1 |
0.366 |
0 |
0 |
0 |
0.000 |
24 |
|
[PYR]B:82 |
3 |
1 |
204 |
◊ |
A |
x,y,z |
1_555 |
8 |
2 |
6588 |
36.0 |
1.2 |
0.371 |
0 |
0 |
0 |
0.000 |
| Average: |
36.8 |
1.1 |
0.368 |
0 |
0 |
0 |
0.000 |
| 17 |
25 |
|
B |
5 |
2 |
12717 |
◊ |
A |
x-y+2/3,-y+4/3,-z+1/3 |
11_565 |
4 |
2 |
6588 |
36.0 |
0.8 |
0.610 |
0 |
0 |
0 |
0.000 |
| 18 |
26 |
|
A |
6 |
2 |
6588 |
◊ |
[PYR]B:82 |
-y+1,x-y,z |
2_655 |
3 |
1 |
204 |
30.4 |
1.4 |
0.000 |
0 |
0 |
0 |
0.000 |
27 |
|
[PYR]D:82 |
3 |
1 |
205 |
◊ |
C |
-y+1,x-y,z |
2_655 |
6 |
2 |
6581 |
30.1 |
1.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
30.2 |
1.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 19 |
28 |
|
D |
2 |
1 |
12707 |
◊ |
D |
-x+4/3,-x+y+2/3,-z-1/3 |
18_654 |
2 |
1 |
12707 |
2.1 |
0.0 |
0.675 |
0 |
0 |
0 |
0.000 |
| 20 |
29 |
|
[PYR]D:82 |
1 |
1 |
205 |
◊ |
D |
-y+1,x-y,z |
2_655 |
1 |
1 |
12707 |
0.4 |
0.0 |
0.766 |
0 |
0 |
0 |
0.000 |
|