## |
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 |
|
F |
132 |
36 |
13538 |
◊ |
E |
x,y,z |
1_555 |
128 |
36 |
13572 |
1054.0 |
-11.8 |
0.281 |
15 |
0 |
0 |
0.543 |
2 |
|
C |
126 |
36 |
13627 |
◊ |
A |
x,y,z |
1_555 |
125 |
36 |
13611 |
1053.6 |
-11.2 |
0.283 |
14 |
0 |
0 |
0.543 |
3 |
|
D |
126 |
36 |
13500 |
◊ |
B |
x,y,z |
1_555 |
126 |
38 |
13626 |
1051.3 |
-12.1 |
0.233 |
17 |
0 |
0 |
0.543 |
Average: |
1053.0 |
-11.7 |
0.266 |
15 |
0 |
0 |
0.543 |
2 |
4 |
|
F |
103 |
27 |
13538 |
◊ |
D |
x,y,z |
1_555 |
104 |
27 |
13500 |
1041.3 |
-22.1 |
0.003 |
8 |
0 |
0 |
0.626 |
5 |
|
E |
104 |
27 |
13572 |
◊ |
C |
x,y,z |
1_555 |
104 |
27 |
13627 |
1035.0 |
-22.8 |
0.002 |
7 |
0 |
0 |
0.626 |
6 |
|
B |
105 |
27 |
13626 |
◊ |
A |
x,y,z |
1_555 |
102 |
27 |
13611 |
1033.5 |
-22.9 |
0.002 |
8 |
0 |
0 |
0.626 |
Average: |
1036.6 |
-22.6 |
0.002 |
8 |
0 |
0 |
0.626 |
3 |
7 |
|
D |
57 |
17 |
13500 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
57 |
16 |
13626 |
522.2 |
-3.8 |
0.442 |
5 |
4 |
0 |
0.080 |
8 |
|
A |
57 |
17 |
13611 |
◊ |
C |
x-1/2,-y+1/2,-z |
4_455 |
56 |
16 |
13627 |
512.8 |
-2.6 |
0.560 |
6 |
3 |
0 |
0.080 |
Average: |
517.5 |
-3.2 |
0.501 |
6 |
4 |
0 |
0.080 |
4 |
9 |
|
F |
52 |
13 |
13538 |
◊ |
B |
x,y,z |
1_555 |
50 |
13 |
13626 |
460.4 |
-3.3 |
0.294 |
7 |
0 |
0 |
0.174 |
10 |
|
C |
54 |
13 |
13627 |
◊ |
B |
x,y,z |
1_555 |
50 |
13 |
13626 |
459.9 |
-3.5 |
0.260 |
8 |
0 |
0 |
0.174 |
11 |
|
D |
50 |
12 |
13500 |
◊ |
A |
x,y,z |
1_555 |
47 |
13 |
13611 |
451.9 |
-3.6 |
0.261 |
8 |
0 |
0 |
0.174 |
12 |
|
F |
52 |
13 |
13538 |
◊ |
C |
x,y,z |
1_555 |
52 |
13 |
13627 |
448.7 |
-3.5 |
0.311 |
7 |
0 |
0 |
0.174 |
13 |
|
E |
50 |
13 |
13572 |
◊ |
A |
x,y,z |
1_555 |
52 |
13 |
13611 |
448.3 |
-3.6 |
0.299 |
8 |
0 |
0 |
0.174 |
14 |
|
E |
49 |
12 |
13572 |
◊ |
D |
x,y,z |
1_555 |
49 |
13 |
13500 |
444.3 |
-3.4 |
0.287 |
6 |
0 |
0 |
0.174 |
Average: |
452.3 |
-3.5 |
0.286 |
7 |
0 |
0 |
0.174 |
5 |
15 |
|
F |
13 |
4 |
13538 |
◊ |
E |
-x+1,y-1/2,-z+1/2 |
3_645 |
11 |
2 |
13572 |
112.3 |
0.7 |
0.759 |
1 |
0 |
0 |
0.000 |
6 |
16 |
|
[EDO]B:414 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
17 |
8 |
13626 |
108.0 |
4.2 |
0.544 |
4 |
0 |
0 |
0.000 |
17 |
|
[EDO]A:413 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
13611 |
107.0 |
4.2 |
0.547 |
4 |
0 |
0 |
0.000 |
Average: |
107.5 |
4.2 |
0.546 |
4 |
0 |
0 |
0.000 |
7 |
18 |
|
[EDO]C:415 |
4 |
1 |
182 |
f |
C |
x,y,z |
1_555 |
17 |
8 |
13627 |
107.3 |
4.3 |
0.547 |
4 |
0 |
0 |
0.000 |
19 |
|
[EDO]F:417 |
4 |
1 |
184 |
f |
F |
x,y,z |
1_555 |
15 |
8 |
13538 |
106.4 |
4.3 |
0.548 |
4 |
0 |
0 |
0.000 |
Average: |
106.9 |
4.3 |
0.548 |
4 |
0 |
0 |
0.000 |
8 |
20 |
|
[EDO]E:416 |
4 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
16 |
8 |
13572 |
107.0 |
4.1 |
0.548 |
4 |
0 |
0 |
0.000 |
9 |
21 |
|
[EDO]A:412 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
23 |
7 |
13611 |
106.6 |
4.1 |
0.553 |
1 |
0 |
0 |
0.000 |
10 |
22 |
|
[ACT]E:411 |
4 |
1 |
184 |
f |
E |
x,y,z |
1_555 |
13 |
5 |
13572 |
73.9 |
0.1 |
0.756 |
3 |
0 |
0 |
0.037 |
11 |
23 |
|
[ACT]A:410 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
17 |
6 |
13611 |
71.8 |
0.1 |
0.735 |
2 |
0 |
0 |
0.022 |
12 |
24 |
|
[ACT]B:409 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
17 |
5 |
13626 |
71.7 |
0.1 |
0.732 |
2 |
0 |
0 |
0.022 |
25 |
|
[ACT]E:411 |
4 |
1 |
184 |
◊ |
F |
x,y,z |
1_555 |
18 |
5 |
13538 |
70.1 |
0.1 |
0.744 |
2 |
0 |
0 |
0.022 |
Average: |
70.9 |
0.1 |
0.738 |
2 |
0 |
0 |
0.022 |
13 |
26 |
|
[ACT]A:410 |
4 |
1 |
183 |
f |
C |
x,y,z |
1_555 |
14 |
6 |
13627 |
71.5 |
0.0 |
0.753 |
3 |
0 |
0 |
0.036 |
14 |
27 |
|
[ACT]B:409 |
4 |
1 |
183 |
f |
D |
x,y,z |
1_555 |
12 |
5 |
13500 |
70.5 |
0.1 |
0.758 |
2 |
0 |
0 |
0.019 |
15 |
28 |
|
F |
8 |
3 |
13538 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
6 |
2 |
13500 |
67.2 |
0.3 |
0.608 |
1 |
2 |
0 |
0.000 |
16 |
29 |
|
[CA]C:403 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
6 |
3 |
13627 |
43.8 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.538 |
30 |
|
[CA]F:406 |
1 |
1 |
85 |
f |
F |
x,y,z |
1_555 |
7 |
3 |
13538 |
42.8 |
-9.3 |
0.000 |
0 |
0 |
0 |
0.538 |
31 |
|
[CA]E:407 |
1 |
1 |
85 |
f |
E |
x,y,z |
1_555 |
7 |
3 |
13572 |
42.0 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.538 |
32 |
|
[CA]D:405 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
5 |
3 |
13500 |
41.5 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.538 |
33 |
|
[CA]B:408 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
13626 |
41.4 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.538 |
34 |
|
[CA]A:404 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
13611 |
41.3 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.538 |
Average: |
42.1 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.538 |
17 |
35 |
|
[CA]D:402 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
7 |
3 |
13500 |
37.6 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.209 |
36 |
|
[CA]A:401 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
13611 |
37.5 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.209 |
Average: |
37.6 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.209 |
18 |
37 |
|
[CA]D:402 |
1 |
1 |
85 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
3 |
1 |
13626 |
28.4 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.062 |
38 |
|
[CA]A:401 |
1 |
1 |
85 |
◊ |
C |
x-1/2,-y+1/2,-z |
4_455 |
3 |
1 |
13627 |
28.4 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.062 |
Average: |
28.4 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.062 |
19 |
39 |
|
B |
1 |
1 |
13626 |
◊ |
C |
x-1/2,-y+1/2,-z |
4_455 |
2 |
1 |
13627 |
10.9 |
0.3 |
0.586 |
0 |
0 |
0 |
0.000 |
20 |
40 |
|
E |
2 |
1 |
13572 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
13500 |
3.9 |
-0.1 |
0.430 |
0 |
0 |
0 |
0.000 |
|