## |
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 |
|
B |
41 |
12 |
15045 |
x |
B |
-x+1,y-1/2,-z+1 |
2_646 |
53 |
18 |
15045 |
456.8 |
2.1 |
0.743 |
10 |
1 |
0 |
0.000 |
2 |
|
A |
57 |
21 |
15038 |
x |
A |
-x+1,y-1/2,-z |
2_645 |
43 |
13 |
15038 |
454.1 |
2.7 |
0.820 |
9 |
0 |
0 |
0.000 |
Average: |
455.4 |
2.4 |
0.782 |
10 |
1 |
0 |
0.000 |
2 |
3 |
|
A |
48 |
15 |
15038 |
x |
A |
x-1,y,z |
1_455 |
32 |
8 |
15038 |
335.4 |
1.0 |
0.715 |
6 |
1 |
0 |
0.000 |
4 |
|
B |
51 |
16 |
15045 |
x |
B |
x-1,y,z |
1_455 |
32 |
9 |
15045 |
334.6 |
0.9 |
0.705 |
5 |
1 |
0 |
0.000 |
Average: |
335.0 |
0.9 |
0.710 |
6 |
1 |
0 |
0.000 |
3 |
5 |
|
B |
35 |
12 |
15045 |
◊ |
A |
x,y,z |
1_555 |
31 |
8 |
15038 |
284.6 |
-4.1 |
0.176 |
3 |
0 |
0 |
0.000 |
4 |
6 |
|
[M8C]D:1 |
13 |
1 |
344 |
f |
B |
x,y,z |
1_555 |
25 |
12 |
15045 |
173.9 |
-0.6 |
0.369 |
5 |
0 |
0 |
0.000 |
7 |
|
[M8C]C:1 |
13 |
1 |
344 |
f |
A |
x,y,z |
1_555 |
25 |
12 |
15038 |
173.6 |
-0.5 |
0.388 |
6 |
0 |
0 |
0.000 |
Average: |
173.7 |
-0.5 |
0.378 |
6 |
0 |
0 |
0.000 |
5 |
8 |
|
A |
23 |
7 |
15038 |
◊ |
B |
x,y,z-1 |
1_554 |
18 |
6 |
15045 |
153.4 |
-2.0 |
0.289 |
2 |
0 |
0 |
0.000 |
6 |
9 |
|
[ADA]D:3 |
12 |
1 |
299 |
f |
B |
x,y,z |
1_555 |
18 |
8 |
15045 |
142.9 |
2.8 |
0.510 |
3 |
0 |
0 |
0.000 |
10 |
|
[ADA]C:3 |
12 |
1 |
298 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
15038 |
142.5 |
2.7 |
0.517 |
3 |
0 |
0 |
0.000 |
Average: |
142.7 |
2.7 |
0.513 |
3 |
0 |
0 |
0.000 |
7 |
11 |
|
[ADA]C:2 |
10 |
1 |
300 |
f |
A |
x,y,z |
1_555 |
24 |
10 |
15038 |
137.5 |
0.9 |
0.354 |
7 |
0 |
0 |
0.000 |
12 |
|
[ADA]D:2 |
10 |
1 |
298 |
f |
B |
x,y,z |
1_555 |
23 |
9 |
15045 |
136.8 |
0.8 |
0.330 |
7 |
0 |
0 |
0.000 |
Average: |
137.1 |
0.8 |
0.342 |
7 |
0 |
0 |
0.000 |
8 |
13 |
|
B |
11 |
4 |
15045 |
x |
B |
-x,y-1/2,-z+1 |
2_546 |
7 |
2 |
15045 |
95.7 |
0.4 |
0.608 |
2 |
0 |
0 |
0.000 |
14 |
|
A |
7 |
2 |
15038 |
x |
A |
-x,y-1/2,-z |
2_545 |
9 |
3 |
15038 |
79.2 |
0.5 |
0.659 |
2 |
0 |
0 |
0.000 |
Average: |
87.5 |
0.5 |
0.634 |
2 |
0 |
0 |
0.000 |
9 |
15 |
|
[ADA]D:4 |
8 |
1 |
298 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
15045 |
93.0 |
1.5 |
0.439 |
1 |
0 |
0 |
0.000 |
10 |
16 |
|
[ADA]D:5 |
9 |
1 |
297 |
cf |
[M8C]D:6 |
x,y,z |
1_555 |
7 |
1 |
340 |
83.3 |
0.5 |
0.249 |
0 |
0 |
0 |
0.000 |
11 |
17 |
|
[ADA]C:4 |
9 |
1 |
298 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
15038 |
74.4 |
1.4 |
0.469 |
0 |
0 |
0 |
0.000 |
12 |
18 |
|
[ADA]C:2 |
8 |
1 |
300 |
cf |
[M8C]C:1 |
x,y,z |
1_555 |
9 |
1 |
344 |
72.2 |
1.3 |
0.353 |
0 |
0 |
0 |
0.000 |
19 |
|
[ADA]D:2 |
8 |
1 |
298 |
cf |
[M8C]D:1 |
x,y,z |
1_555 |
9 |
1 |
344 |
70.9 |
1.3 |
0.342 |
0 |
0 |
0 |
0.000 |
Average: |
71.6 |
1.3 |
0.347 |
0 |
0 |
0 |
0.000 |
13 |
20 |
|
[ADA]C:5 |
9 |
1 |
298 |
cf |
[M8C]C:6 |
x,y,z |
1_555 |
6 |
1 |
339 |
70.7 |
1.1 |
0.271 |
0 |
0 |
0 |
0.000 |
14 |
21 |
|
[ADA]D:5 |
8 |
1 |
297 |
cf |
[ADA]D:4 |
x,y,z |
1_555 |
8 |
1 |
298 |
67.0 |
1.5 |
0.218 |
0 |
0 |
0 |
0.000 |
15 |
22 |
|
[ADA]D:3 |
7 |
1 |
299 |
cf |
[ADA]D:2 |
x,y,z |
1_555 |
8 |
1 |
298 |
65.3 |
1.3 |
0.193 |
0 |
0 |
0 |
0.000 |
23 |
|
[ADA]C:3 |
7 |
1 |
298 |
cf |
[ADA]C:2 |
x,y,z |
1_555 |
8 |
1 |
300 |
65.2 |
1.3 |
0.194 |
0 |
0 |
0 |
0.000 |
24 |
|
[ADA]C:5 |
7 |
1 |
298 |
cf |
[ADA]C:4 |
x,y,z |
1_555 |
7 |
1 |
298 |
64.6 |
1.3 |
0.258 |
0 |
0 |
0 |
0.000 |
Average: |
65.0 |
1.3 |
0.215 |
0 |
0 |
0 |
0.000 |
16 |
25 |
|
[ADA]D:4 |
7 |
1 |
298 |
cf |
[ADA]D:3 |
x,y,z |
1_555 |
8 |
1 |
299 |
64.8 |
1.4 |
0.222 |
0 |
0 |
0 |
0.000 |
17 |
26 |
|
[ADA]C:4 |
8 |
1 |
298 |
cf |
[ADA]C:3 |
x,y,z |
1_555 |
8 |
1 |
298 |
64.3 |
1.2 |
0.195 |
0 |
0 |
0 |
0.000 |
18 |
27 |
|
[M8C]D:6 |
1 |
1 |
340 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
15045 |
15.9 |
-0.4 |
0.351 |
0 |
0 |
0 |
0.000 |
19 |
28 |
|
[ADA]C:5 |
1 |
1 |
298 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
15038 |
10.2 |
-0.0 |
0.283 |
0 |
0 |
0 |
0.000 |
20 |
29 |
|
[ADA]D:5 |
2 |
1 |
297 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
15045 |
9.1 |
0.0 |
0.287 |
0 |
0 |
0 |
0.000 |
21 |
30 |
|
[ADA]D:4 |
3 |
1 |
298 |
f |
[M8C]D:6 |
x,y,z |
1_555 |
2 |
1 |
340 |
7.5 |
0.0 |
0.357 |
0 |
0 |
0 |
0.000 |
22 |
31 |
|
[ADA]C:5 |
1 |
1 |
298 |
f |
[ADA]C:3 |
x,y,z |
1_555 |
1 |
1 |
298 |
2.3 |
0.0 |
0.250 |
0 |
0 |
0 |
0.000 |
23 |
32 |
|
[ADA]D:4 |
1 |
1 |
298 |
f |
[ADA]D:2 |
x,y,z |
1_555 |
1 |
1 |
298 |
1.1 |
0.0 |
0.250 |
0 |
0 |
0 |
0.000 |
24 |
33 |
|
[ADA]D:3 |
1 |
1 |
299 |
f |
[M8C]D:1 |
x,y,z |
1_555 |
1 |
1 |
344 |
0.5 |
0.0 |
0.267 |
0 |
0 |
0 |
0.000 |
34 |
|
[ADA]C:3 |
1 |
1 |
298 |
f |
[M8C]C:1 |
x,y,z |
1_555 |
1 |
1 |
344 |
0.5 |
-0.0 |
0.267 |
0 |
0 |
0 |
0.000 |
Average: |
0.5 |
-0.0 |
0.267 |
0 |
0 |
0 |
0.000 |
25 |
35 |
|
[ADA]C:4 |
1 |
1 |
298 |
f |
[ADA]C:2 |
x,y,z |
1_555 |
1 |
1 |
300 |
0.1 |
0.0 |
0.250 |
0 |
0 |
0 |
0.000 |
|