## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
B |
88 |
28 |
15925 |
◊ |
A |
x,y,z |
1_555 |
76 |
22 |
20527 |
750.8 |
-2.8 |
0.491 |
12 |
4 |
0 |
0.000 |
2 |
|
A |
55 |
16 |
20527 |
x |
A |
x-1,y,z |
1_455 |
53 |
19 |
20527 |
531.5 |
-0.8 |
0.565 |
8 |
2 |
0 |
0.000 |
3 |
|
[ATP]B:404 |
30 |
1 |
646 |
f |
B |
x,y,z |
1_555 |
72 |
24 |
15925 |
438.3 |
-2.9 |
0.517 |
18 |
0 |
0 |
0.087 |
4 |
|
B |
44 |
10 |
15925 |
x |
B |
x-1,y,z |
1_455 |
45 |
16 |
15925 |
433.6 |
-0.1 |
0.633 |
7 |
3 |
0 |
0.000 |
5 |
|
[LAR]B:403 |
26 |
1 |
600 |
f |
B |
x,y,z |
1_555 |
51 |
18 |
15925 |
412.2 |
-1.7 |
0.385 |
4 |
0 |
0 |
0.028 |
6 |
|
[AR6]B:401 |
30 |
1 |
693 |
◊ |
A |
x,y,z |
1_555 |
47 |
19 |
20527 |
401.7 |
-7.0 |
0.486 |
8 |
0 |
0 |
0.000 |
7 |
|
B |
47 |
20 |
15925 |
◊ |
A |
-x-1,y-1/2,-z+1/2 |
3_445 |
31 |
7 |
20527 |
383.8 |
-8.4 |
0.007 |
3 |
3 |
0 |
0.000 |
8 |
|
B |
31 |
9 |
15925 |
x |
B |
x-1/2,-y-1/2,-z |
4_445 |
39 |
9 |
15925 |
338.2 |
-1.1 |
0.370 |
9 |
2 |
0 |
0.000 |
9 |
|
B |
23 |
7 |
15925 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
18 |
8 |
20527 |
167.2 |
-0.9 |
0.457 |
2 |
0 |
0 |
0.000 |
10 |
|
B |
17 |
6 |
15925 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
15 |
6 |
20527 |
138.9 |
0.8 |
0.694 |
3 |
1 |
0 |
0.000 |
11 |
|
[EDO]A:502 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
21 |
10 |
20527 |
121.3 |
6.0 |
0.837 |
4 |
0 |
0 |
0.000 |
12 |
|
[PO4]A:501 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
20527 |
118.4 |
-7.5 |
0.701 |
3 |
0 |
0 |
0.000 |
13 |
|
[EDO]A:509 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
20527 |
117.3 |
5.4 |
0.585 |
3 |
0 |
0 |
0.000 |
14 |
|
[EDO]A:505 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
20527 |
113.1 |
3.7 |
0.470 |
4 |
0 |
0 |
0.000 |
15 |
|
[EDO]B:408 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
15925 |
111.1 |
2.5 |
0.301 |
3 |
0 |
0 |
0.000 |
16 |
|
[EDO]B:405 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
18 |
8 |
15925 |
110.9 |
3.7 |
0.470 |
1 |
0 |
0 |
0.000 |
17 |
|
[EDO]A:508 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
16 |
7 |
20527 |
108.6 |
4.1 |
0.550 |
3 |
0 |
0 |
0.000 |
18 |
|
[EDO]B:412 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
20 |
8 |
15925 |
107.8 |
3.4 |
0.455 |
2 |
0 |
0 |
0.000 |
19 |
|
[EDO]A:507 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
20527 |
103.1 |
4.0 |
0.525 |
3 |
0 |
0 |
0.000 |
20 |
|
[EDO]A:510 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
17 |
8 |
20527 |
101.5 |
3.7 |
0.510 |
3 |
0 |
0 |
0.000 |
21 |
|
[EDO]B:411 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
15 |
7 |
15925 |
100.0 |
3.4 |
0.471 |
3 |
0 |
0 |
0.000 |
22 |
|
[EDO]B:410 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
16 |
7 |
15925 |
96.8 |
3.9 |
0.573 |
3 |
0 |
0 |
0.000 |
23 |
|
[EDO]B:413 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
13 |
8 |
15925 |
90.6 |
3.0 |
0.503 |
2 |
0 |
0 |
0.000 |
24 |
|
[EDO]B:407 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
12 |
8 |
15925 |
88.4 |
3.4 |
0.615 |
4 |
0 |
0 |
0.000 |
25 |
|
[EDO]A:504 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
17 |
6 |
20527 |
83.8 |
2.4 |
0.461 |
2 |
0 |
0 |
0.000 |
26 |
|
[EDO]B:406 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
9 |
5 |
20527 |
80.7 |
2.8 |
0.317 |
2 |
0 |
0 |
0.000 |
27 |
|
[EDO]B:409 |
3 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
15925 |
79.1 |
3.2 |
0.644 |
2 |
0 |
0 |
0.000 |
28 |
|
B |
10 |
3 |
15925 |
◊ |
[EDO]A:506 |
-x,y-1/2,-z+1/2 |
3_545 |
4 |
1 |
184 |
75.0 |
2.0 |
0.794 |
1 |
0 |
0 |
0.000 |
29 |
|
[EDO]B:409 |
4 |
1 |
184 |
f |
B |
x-1,y,z |
1_455 |
11 |
4 |
15925 |
73.6 |
2.4 |
0.306 |
4 |
0 |
0 |
0.000 |
30 |
|
[EDO]A:503 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
11 |
4 |
20527 |
71.8 |
1.6 |
0.204 |
2 |
0 |
0 |
0.000 |
31 |
|
[AR6]B:401 |
5 |
1 |
693 |
cf |
B |
x,y,z |
1_555 |
6 |
2 |
15925 |
64.9 |
1.4 |
0.740 |
0 |
0 |
0 |
0.000 |
32 |
|
[EDO]A:503 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
13 |
4 |
15925 |
64.6 |
1.3 |
0.193 |
2 |
0 |
0 |
0.000 |
33 |
|
[EDO]A:506 |
3 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
9 |
3 |
20527 |
59.7 |
2.0 |
0.299 |
2 |
0 |
0 |
0.000 |
34 |
|
[EDO]A:504 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
11 |
3 |
15925 |
58.3 |
0.9 |
0.177 |
0 |
0 |
0 |
0.000 |
35 |
|
[EDO]B:406 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
15925 |
57.4 |
1.6 |
0.834 |
1 |
0 |
0 |
0.000 |
36 |
|
B |
6 |
3 |
15925 |
f |
[EDO]B:411 |
x-1,y,z |
1_455 |
4 |
1 |
185 |
53.7 |
1.7 |
0.962 |
1 |
0 |
0 |
0.000 |
37 |
|
[ATP]B:404 |
6 |
1 |
646 |
f |
[LAR]B:403 |
x,y,z |
1_555 |
7 |
1 |
600 |
49.4 |
-0.4 |
0.441 |
0 |
0 |
0 |
0.003 |
38 |
|
[CA]B:402 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
15 |
7 |
15925 |
46.9 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.057 |
39 |
|
[ATP]B:404 |
4 |
1 |
646 |
f |
[EDO]B:412 |
x,y,z |
1_555 |
3 |
1 |
183 |
37.4 |
1.2 |
0.807 |
1 |
0 |
0 |
0.000 |
40 |
|
A |
8 |
3 |
20527 |
◊ |
[AR6]B:401 |
x-1,y,z |
1_455 |
3 |
1 |
693 |
37.2 |
0.5 |
0.624 |
0 |
0 |
0 |
0.000 |
41 |
|
[EDO]B:413 |
3 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
20527 |
35.3 |
0.9 |
0.667 |
0 |
0 |
0 |
0.000 |
42 |
|
B |
2 |
1 |
15925 |
f |
[EDO]B:410 |
x-1/2,-y-1/2,-z |
4_445 |
2 |
1 |
184 |
31.7 |
0.1 |
0.469 |
0 |
0 |
0 |
0.000 |
43 |
|
[ATP]B:404 |
4 |
1 |
646 |
f |
[CA]B:402 |
x,y,z |
1_555 |
1 |
1 |
85 |
29.6 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.049 |
44 |
|
[EDO]B:407 |
2 |
1 |
185 |
f |
A |
-x-1,y-1/2,-z+1/2 |
3_445 |
2 |
1 |
20527 |
29.3 |
0.3 |
0.317 |
0 |
0 |
0 |
0.000 |
45 |
|
[AR6]B:401 |
4 |
1 |
693 |
f |
[EDO]B:406 |
x,y,z |
1_555 |
2 |
1 |
184 |
26.7 |
0.2 |
0.734 |
0 |
0 |
0 |
0.000 |
46 |
|
[EDO]A:508 |
3 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
15925 |
24.5 |
1.1 |
0.921 |
0 |
0 |
0 |
0.000 |
47 |
|
[EDO]A:504 |
1 |
1 |
185 |
f |
[EDO]A:503 |
x,y,z |
1_555 |
2 |
1 |
185 |
13.5 |
0.6 |
1.000 |
0 |
0 |
0 |
0.000 |
|