| ## |
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 |
79 |
22 |
12153 |
◊ |
C |
x-1,y,z |
1_455 |
72 |
21 |
12608 |
696.4 |
-7.0 |
0.409 |
6 |
0 |
0 |
0.000 |
2 |
|
C |
81 |
22 |
12608 |
◊ |
A |
x,y,z |
1_555 |
70 |
20 |
12153 |
695.8 |
-7.9 |
0.390 |
4 |
0 |
0 |
0.000 |
3 |
|
D |
78 |
23 |
12214 |
◊ |
B |
x,y,z-1 |
1_554 |
75 |
21 |
12392 |
690.2 |
-8.5 |
0.392 |
4 |
0 |
0 |
0.000 |
4 |
|
D |
64 |
19 |
12214 |
◊ |
B |
x-1,y,z-1 |
1_454 |
68 |
20 |
12392 |
606.2 |
-6.6 |
0.372 |
5 |
0 |
0 |
0.000 |
| Average: |
672.1 |
-7.5 |
0.391 |
5 |
0 |
0 |
0.000 |
| 2 |
5 |
|
C |
61 |
20 |
12608 |
◊ |
B |
x,y,z |
1_555 |
61 |
20 |
12392 |
598.6 |
-14.8 |
0.029 |
0 |
0 |
0 |
0.717 |
6 |
|
D |
61 |
19 |
12214 |
◊ |
A |
x,y,z |
1_555 |
59 |
19 |
12153 |
592.3 |
-14.8 |
0.027 |
0 |
0 |
0 |
0.717 |
| Average: |
595.5 |
-14.8 |
0.028 |
0 |
0 |
0 |
0.717 |
| 3 |
7 |
|
[CPQ]A:402 |
37 |
1 |
1137 |
f |
A |
x,y,z |
1_555 |
42 |
15 |
12153 |
351.6 |
-3.8 |
0.519 |
2 |
0 |
0 |
0.151 |
| 4 |
8 |
|
[CPQ]D:401 |
28 |
1 |
880 |
◊ |
D |
x,y,z |
1_555 |
36 |
13 |
12214 |
282.9 |
-0.3 |
0.467 |
2 |
0 |
0 |
0.037 |
| 5 |
9 |
|
C |
33 |
11 |
12608 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
31 |
11 |
12214 |
278.2 |
1.7 |
0.875 |
3 |
0 |
0 |
0.000 |
10 |
|
B |
26 |
8 |
12392 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
36 |
13 |
12153 |
271.9 |
2.1 |
0.884 |
3 |
0 |
0 |
0.000 |
| Average: |
275.0 |
1.9 |
0.880 |
3 |
0 |
0 |
0.000 |
| 6 |
11 |
|
[CPQ]C:402 |
20 |
1 |
608 |
◊ |
C |
x,y,z |
1_555 |
29 |
11 |
12608 |
222.6 |
-0.4 |
0.489 |
1 |
0 |
0 |
0.039 |
| 7 |
12 |
|
[CPQ]A:404 |
19 |
1 |
706 |
◊ |
A |
x,y,z |
1_555 |
28 |
10 |
12153 |
220.2 |
0.2 |
0.520 |
1 |
0 |
0 |
0.007 |
| 8 |
13 |
|
[CPQ]B:402 |
23 |
1 |
835 |
◊ |
B |
x,y,z |
1_555 |
27 |
10 |
12392 |
215.6 |
-0.7 |
0.640 |
2 |
0 |
0 |
0.000 |
| 9 |
14 |
|
[CPQ]A:405 |
20 |
1 |
553 |
f |
A |
x,y,z |
1_555 |
28 |
12 |
12153 |
204.0 |
-0.8 |
0.318 |
0 |
0 |
0 |
0.027 |
| 10 |
15 |
|
[CPQ]A:404 |
22 |
1 |
706 |
f |
D |
x,y,z |
1_555 |
23 |
7 |
12214 |
202.0 |
-3.3 |
0.167 |
0 |
0 |
0 |
0.106 |
| 11 |
16 |
|
[CPQ]C:403 |
15 |
1 |
654 |
f |
C |
x,y,z |
1_555 |
26 |
11 |
12608 |
191.0 |
-0.8 |
0.503 |
0 |
0 |
0 |
0.039 |
| 12 |
17 |
|
[CPQ]A:403 |
15 |
1 |
562 |
◊ |
D |
x,y,z |
1_555 |
22 |
9 |
12214 |
170.1 |
0.9 |
0.418 |
0 |
0 |
0 |
0.000 |
| 13 |
18 |
|
[CPQ]A:403 |
15 |
1 |
562 |
f |
A |
x,y,z |
1_555 |
24 |
8 |
12153 |
167.1 |
-1.6 |
0.214 |
0 |
0 |
0 |
0.053 |
| 14 |
19 |
|
[CPQ]B:403 |
14 |
1 |
458 |
f |
C |
x,y,z |
1_555 |
19 |
8 |
12608 |
159.1 |
-1.4 |
0.298 |
0 |
0 |
0 |
0.068 |
| 15 |
20 |
|
[CPQ]B:403 |
12 |
1 |
458 |
◊ |
B |
x,y,z |
1_555 |
22 |
9 |
12392 |
151.7 |
-0.4 |
0.453 |
0 |
0 |
0 |
0.020 |
| 16 |
21 |
|
[CPQ]A:402 |
10 |
1 |
1137 |
◊ |
C |
x-1,y,z |
1_455 |
19 |
6 |
12608 |
131.4 |
-1.3 |
0.447 |
3 |
0 |
0 |
0.000 |
| 17 |
22 |
|
[CPQ]C:401 |
10 |
1 |
456 |
◊ |
[CPQ]B:402 |
x-1,y,z |
1_455 |
14 |
1 |
835 |
110.3 |
1.8 |
0.639 |
0 |
0 |
0 |
0.000 |
| 18 |
23 |
|
[CPQ]D:401 |
12 |
1 |
880 |
f |
A |
x,y,z |
1_555 |
15 |
4 |
12153 |
96.8 |
-1.7 |
0.266 |
0 |
0 |
0 |
0.055 |
| 19 |
24 |
|
[CPQ]C:402 |
8 |
1 |
608 |
f |
B |
x,y,z |
1_555 |
13 |
4 |
12392 |
92.0 |
-2.2 |
0.230 |
0 |
0 |
0 |
0.109 |
| 20 |
25 |
|
[CPQ]A:402 |
11 |
1 |
1137 |
◊ |
[CPQ]A:405 |
x-1,y,z |
1_455 |
12 |
1 |
553 |
90.9 |
-0.3 |
0.304 |
1 |
0 |
0 |
0.000 |
| 21 |
26 |
|
[CPQ]A:402 |
11 |
1 |
1137 |
◊ |
D |
x,y,z |
1_555 |
15 |
4 |
12214 |
90.7 |
-1.6 |
0.443 |
0 |
0 |
0 |
0.050 |
| 22 |
27 |
|
[CPQ]B:402 |
10 |
1 |
835 |
◊ |
C |
x,y,z |
1_555 |
14 |
4 |
12608 |
89.7 |
-1.4 |
0.449 |
0 |
0 |
0 |
0.000 |
| 23 |
28 |
|
[CPQ]C:401 |
10 |
1 |
456 |
f |
[CPQ]C:403 |
x-1,y,z |
1_455 |
8 |
1 |
654 |
88.5 |
3.0 |
0.633 |
0 |
0 |
0 |
0.000 |
| 24 |
29 |
|
[CPQ]C:402 |
5 |
1 |
608 |
◊ |
[CPQ]C:401 |
x,y,z |
1_555 |
9 |
1 |
456 |
78.3 |
0.5 |
0.439 |
0 |
0 |
0 |
0.000 |
| 25 |
30 |
|
A |
7 |
2 |
12153 |
f |
[CPQ]D:402 |
x-1,y,z |
1_455 |
7 |
1 |
465 |
73.7 |
-1.7 |
0.183 |
0 |
0 |
0 |
0.054 |
| 26 |
31 |
|
[CPQ]D:402 |
9 |
1 |
465 |
◊ |
[CPQ]D:401 |
x,y,z |
1_555 |
7 |
1 |
880 |
71.2 |
0.6 |
0.395 |
0 |
0 |
0 |
0.000 |
| 27 |
32 |
|
[CPQ]A:402 |
7 |
1 |
1137 |
f |
[CPQ]D:402 |
x-1,y,z |
1_455 |
7 |
1 |
465 |
66.4 |
2.4 |
0.651 |
0 |
0 |
0 |
0.000 |
| 28 |
33 |
|
[CPQ]C:401 |
5 |
1 |
456 |
◊ |
B |
x-1,y,z |
1_455 |
5 |
2 |
12392 |
64.9 |
0.6 |
0.301 |
0 |
0 |
0 |
0.000 |
| 29 |
34 |
|
[CPQ]C:402 |
5 |
1 |
608 |
◊ |
[CPQ]B:402 |
x-1,y,z |
1_455 |
8 |
1 |
835 |
58.0 |
0.7 |
0.617 |
0 |
0 |
0 |
0.000 |
| 30 |
35 |
|
[CPQ]C:401 |
7 |
1 |
456 |
f |
C |
x-1,y,z |
1_455 |
5 |
3 |
12608 |
53.4 |
-1.4 |
0.201 |
0 |
0 |
0 |
0.068 |
| 31 |
36 |
|
[CPQ]A:402 |
6 |
1 |
1137 |
◊ |
[CPQ]A:404 |
x,y,z |
1_555 |
7 |
1 |
706 |
52.0 |
-1.2 |
0.332 |
0 |
0 |
0 |
0.038 |
| 32 |
37 |
|
[CPQ]A:403 |
7 |
1 |
562 |
f |
[CPQ]D:401 |
x,y,z |
1_555 |
6 |
1 |
880 |
51.9 |
-1.1 |
0.153 |
0 |
0 |
0 |
0.036 |
| 33 |
38 |
|
D |
3 |
2 |
12214 |
◊ |
[CPQ]D:402 |
x-1,y,z |
1_455 |
7 |
1 |
465 |
50.3 |
-0.8 |
0.170 |
0 |
0 |
0 |
0.026 |
| 34 |
39 |
|
[CPQ]B:402 |
6 |
1 |
835 |
◊ |
[CPQ]B:403 |
x,y,z |
1_555 |
6 |
1 |
458 |
48.2 |
-1.1 |
0.362 |
0 |
0 |
0 |
0.000 |
| 35 |
40 |
|
[CPQ]A:405 |
4 |
1 |
553 |
◊ |
C |
x,y,z |
1_555 |
4 |
1 |
12608 |
47.2 |
-0.3 |
0.364 |
0 |
0 |
0 |
0.000 |
| 36 |
41 |
|
C |
5 |
2 |
12608 |
f |
[CPQ]B:402 |
x-1,y,z |
1_455 |
5 |
1 |
835 |
46.5 |
-2.6 |
0.189 |
0 |
0 |
0 |
0.128 |
| 37 |
42 |
|
[CPQ]C:403 |
6 |
1 |
654 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
12392 |
44.7 |
-0.4 |
0.225 |
0 |
0 |
0 |
0.018 |
43 |
|
[CPQ]A:405 |
5 |
1 |
553 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
12214 |
44.2 |
0.3 |
0.258 |
0 |
0 |
0 |
0.018 |
| Average: |
44.5 |
-0.0 |
0.242 |
0 |
0 |
0 |
0.018 |
| 38 |
44 |
|
B |
3 |
3 |
12392 |
◊ |
[CPQ]B:402 |
x-1,y,z |
1_455 |
2 |
1 |
835 |
32.3 |
-0.1 |
0.393 |
0 |
0 |
0 |
0.006 |
| 39 |
45 |
|
[CA]A:401 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
12214 |
27.4 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.288 |
46 |
|
[CA]B:401 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
12392 |
27.2 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.288 |
47 |
|
[CA]A:401 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
12153 |
26.5 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.288 |
48 |
|
[CA]B:401 |
1 |
1 |
85 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
12608 |
26.2 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.288 |
| Average: |
26.8 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.288 |
| 40 |
49 |
|
[CPQ]A:402 |
3 |
1 |
1137 |
◊ |
A |
x-1,y,z |
1_455 |
3 |
1 |
12153 |
22.1 |
-0.1 |
0.443 |
0 |
0 |
0 |
0.000 |
| 41 |
50 |
|
[CPQ]C:402 |
2 |
1 |
608 |
◊ |
[CPQ]C:403 |
x-1,y,z |
1_455 |
5 |
1 |
654 |
16.8 |
0.1 |
0.446 |
0 |
0 |
0 |
0.000 |
| 42 |
51 |
|
[CPQ]C:401 |
2 |
1 |
456 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
12608 |
11.2 |
-0.3 |
0.405 |
0 |
0 |
0 |
0.000 |
| 43 |
52 |
|
[CPQ]D:402 |
1 |
1 |
465 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
12214 |
3.0 |
-0.1 |
0.494 |
0 |
0 |
0 |
0.000 |
| 44 |
53 |
|
C |
1 |
1 |
12608 |
◊ |
[CPQ]C:403 |
x-1,y,z |
1_455 |
1 |
1 |
654 |
0.7 |
-0.0 |
0.530 |
0 |
0 |
0 |
0.000 |
|