| ## |
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 |
468 |
117 |
24134 |
◊ |
A |
x,y,z |
1_555 |
473 |
128 |
19244 |
4422.0 |
-56.4 |
0.016 |
56 |
16 |
0 |
0.544 |
2 |
|
D |
464 |
116 |
24129 |
◊ |
C |
x,y,z |
1_555 |
475 |
127 |
19189 |
4416.7 |
-55.5 |
0.018 |
54 |
15 |
0 |
0.544 |
| Average: |
4419.3 |
-56.0 |
0.017 |
55 |
16 |
0 |
0.544 |
| 2 |
3 |
|
D |
315 |
78 |
24129 |
◊ |
B |
x,y,z |
1_555 |
314 |
77 |
24134 |
2895.0 |
-23.5 |
0.360 |
40 |
22 |
0 |
0.698 |
| 3 |
4 |
|
D |
141 |
37 |
24129 |
◊ |
A |
x,y,z |
1_555 |
149 |
39 |
19244 |
1283.5 |
-18.7 |
0.095 |
13 |
5 |
0 |
0.332 |
5 |
|
B |
140 |
37 |
24134 |
◊ |
C |
x,y,z |
1_555 |
149 |
39 |
19189 |
1271.3 |
-18.8 |
0.095 |
12 |
5 |
0 |
0.332 |
| Average: |
1277.4 |
-18.7 |
0.095 |
13 |
5 |
0 |
0.332 |
| 4 |
6 |
|
[CFM]C:497 |
16 |
1 |
498 |
f |
C |
x,y,z |
1_555 |
47 |
17 |
19189 |
318.3 |
-19.1 |
0.675 |
3 |
0 |
0 |
0.267 |
7 |
|
[CFM]A:496 |
17 |
1 |
497 |
f |
A |
x,y,z |
1_555 |
46 |
17 |
19244 |
317.4 |
-19.0 |
0.754 |
3 |
0 |
0 |
0.267 |
| Average: |
317.9 |
-19.0 |
0.715 |
3 |
0 |
0 |
0.267 |
| 5 |
8 |
|
A |
29 |
9 |
19244 |
◊ |
D |
x-1,y,z |
1_455 |
26 |
7 |
24129 |
254.8 |
-2.9 |
0.371 |
2 |
2 |
0 |
0.000 |
9 |
|
B |
26 |
7 |
24134 |
◊ |
C |
x-1,y,z |
1_455 |
28 |
9 |
19189 |
249.7 |
-3.0 |
0.362 |
2 |
2 |
0 |
0.000 |
| Average: |
252.3 |
-2.9 |
0.366 |
2 |
2 |
0 |
0.000 |
| 6 |
10 |
|
[HCA]A:494 |
13 |
1 |
353 |
f |
A |
x,y,z |
1_555 |
40 |
19 |
19244 |
207.0 |
-0.3 |
0.442 |
4 |
0 |
0 |
0.028 |
11 |
|
[HCA]C:495 |
13 |
1 |
351 |
f |
C |
x,y,z |
1_555 |
39 |
19 |
19189 |
206.3 |
-0.4 |
0.428 |
4 |
0 |
0 |
0.028 |
| Average: |
206.6 |
-0.3 |
0.435 |
4 |
0 |
0 |
0.028 |
| 7 |
12 |
|
A |
23 |
7 |
19244 |
x |
A |
-x,y-1/2,-z |
2_545 |
21 |
6 |
19244 |
196.3 |
-2.9 |
0.252 |
0 |
0 |
0 |
0.000 |
13 |
|
C |
19 |
5 |
19189 |
x |
C |
-x+1,y-1/2,-z |
2_645 |
21 |
6 |
19189 |
175.1 |
-3.1 |
0.214 |
0 |
0 |
0 |
0.000 |
| Average: |
185.7 |
-3.0 |
0.233 |
0 |
0 |
0 |
0.000 |
| 8 |
14 |
|
A |
27 |
6 |
19244 |
◊ |
C |
x-1,y,z |
1_455 |
26 |
6 |
19189 |
194.6 |
-1.0 |
0.615 |
2 |
4 |
0 |
0.000 |
| 9 |
15 |
|
[CLP]C:499 |
13 |
1 |
471 |
f |
C |
x,y,z |
1_555 |
29 |
11 |
19189 |
189.9 |
-20.0 |
0.111 |
1 |
0 |
0 |
0.266 |
16 |
|
[CLP]A:498 |
13 |
1 |
470 |
f |
A |
x,y,z |
1_555 |
29 |
11 |
19244 |
187.5 |
-19.8 |
0.113 |
0 |
0 |
0 |
0.266 |
| Average: |
188.7 |
-19.9 |
0.112 |
1 |
0 |
0 |
0.266 |
| 10 |
17 |
|
[CLP]C:499 |
13 |
1 |
471 |
◊ |
D |
x,y,z |
1_555 |
24 |
11 |
24129 |
181.1 |
-17.9 |
0.082 |
0 |
0 |
0 |
0.117 |
18 |
|
[CLP]A:498 |
13 |
1 |
470 |
◊ |
B |
x,y,z |
1_555 |
23 |
11 |
24134 |
180.1 |
-17.8 |
0.083 |
0 |
0 |
0 |
0.117 |
| Average: |
180.6 |
-17.9 |
0.082 |
0 |
0 |
0 |
0.117 |
| 11 |
19 |
|
A |
31 |
15 |
19244 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
17 |
8 |
24134 |
170.5 |
2.4 |
0.904 |
2 |
0 |
0 |
0.000 |
20 |
|
D |
17 |
8 |
24129 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
31 |
15 |
19189 |
164.3 |
2.5 |
0.909 |
1 |
0 |
0 |
0.000 |
| Average: |
167.4 |
2.4 |
0.906 |
2 |
0 |
0 |
0.000 |
| 12 |
21 |
|
A |
15 |
5 |
19244 |
◊ |
D |
x-1,y,z-1 |
1_454 |
13 |
3 |
24129 |
139.0 |
-1.1 |
0.494 |
2 |
1 |
0 |
0.000 |
| 13 |
22 |
|
C |
11 |
4 |
19189 |
◊ |
D |
x,y,z-1 |
1_554 |
11 |
5 |
24129 |
71.4 |
0.8 |
0.790 |
1 |
0 |
0 |
0.000 |
| 14 |
23 |
|
[CFM]A:496 |
7 |
1 |
497 |
f |
[HCA]A:494 |
x,y,z |
1_555 |
7 |
1 |
353 |
69.5 |
-3.9 |
0.433 |
0 |
0 |
0 |
0.052 |
24 |
|
[CFM]C:497 |
7 |
1 |
498 |
f |
[HCA]C:495 |
x,y,z |
1_555 |
7 |
1 |
351 |
69.2 |
-3.9 |
0.433 |
0 |
0 |
0 |
0.052 |
| Average: |
69.4 |
-3.9 |
0.433 |
0 |
0 |
0 |
0.052 |
| 15 |
25 |
|
C |
6 |
3 |
19189 |
◊ |
B |
x,y,z-1 |
1_554 |
6 |
3 |
24134 |
43.5 |
0.2 |
0.648 |
1 |
0 |
0 |
0.000 |
| 16 |
26 |
|
[HCA]A:494 |
7 |
1 |
353 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
24134 |
41.8 |
1.0 |
0.578 |
0 |
0 |
0 |
0.000 |
27 |
|
[HCA]C:495 |
6 |
1 |
351 |
◊ |
D |
x,y,z |
1_555 |
6 |
3 |
24129 |
41.7 |
1.0 |
0.583 |
0 |
0 |
0 |
0.000 |
| Average: |
41.7 |
1.0 |
0.581 |
0 |
0 |
0 |
0.000 |
| 17 |
28 |
|
[CA]D:524 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
24134 |
27.6 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.151 |
29 |
|
[CA]B:524 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
7 |
4 |
24129 |
27.1 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.151 |
| Average: |
27.4 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.151 |
| 18 |
30 |
|
[CA]B:524 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
24134 |
25.7 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.151 |
31 |
|
[CA]D:524 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
6 |
2 |
24129 |
25.5 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.151 |
| Average: |
25.6 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.151 |
| 19 |
32 |
|
[CA]B:524 |
1 |
1 |
85 |
◊ |
C |
x,y,z |
1_555 |
5 |
2 |
19189 |
19.9 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.016 |
33 |
|
[CA]D:524 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
19244 |
19.6 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.016 |
| Average: |
19.7 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.016 |
| 20 |
34 |
|
D |
3 |
3 |
24129 |
◊ |
B |
x,y,z-1 |
1_554 |
7 |
3 |
24134 |
16.5 |
-0.1 |
0.591 |
0 |
0 |
0 |
0.000 |
|