## |
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 |
|
E |
87 |
23 |
10898 |
◊ |
D |
x,y,z |
1_555 |
83 |
22 |
10902 |
754.9 |
-4.5 |
0.437 |
10 |
5 |
0 |
0.409 |
2 |
|
F |
81 |
22 |
10952 |
◊ |
D |
x,y,z |
1_555 |
90 |
23 |
10902 |
752.1 |
-4.6 |
0.434 |
9 |
4 |
0 |
0.409 |
3 |
|
C |
81 |
22 |
10948 |
◊ |
B |
x,y,z |
1_555 |
86 |
23 |
10955 |
751.4 |
-5.9 |
0.314 |
10 |
4 |
0 |
0.409 |
4 |
|
C |
86 |
22 |
10948 |
◊ |
A |
x,y,z |
1_555 |
82 |
22 |
10983 |
751.3 |
-4.4 |
0.431 |
10 |
4 |
0 |
0.409 |
5 |
|
F |
93 |
23 |
10952 |
◊ |
E |
x,y,z |
1_555 |
85 |
23 |
10898 |
749.4 |
-4.1 |
0.471 |
10 |
4 |
0 |
0.409 |
6 |
|
B |
81 |
21 |
10955 |
◊ |
A |
x,y,z |
1_555 |
88 |
23 |
10983 |
749.3 |
-4.3 |
0.444 |
9 |
4 |
0 |
0.409 |
Average: |
751.4 |
-4.6 |
0.422 |
10 |
4 |
0 |
0.409 |
2 |
7 |
|
F |
35 |
9 |
10952 |
◊ |
C |
x-1,y-1,z |
1_445 |
35 |
9 |
10948 |
362.8 |
-3.5 |
0.281 |
6 |
3 |
0 |
0.000 |
8 |
|
E |
36 |
9 |
10898 |
◊ |
A |
x-1,y,z |
1_455 |
36 |
9 |
10983 |
358.2 |
-3.4 |
0.303 |
6 |
3 |
0 |
0.000 |
9 |
|
D |
33 |
9 |
10902 |
◊ |
B |
x,y,z |
1_555 |
36 |
10 |
10955 |
358.0 |
-3.7 |
0.267 |
6 |
2 |
0 |
0.000 |
Average: |
359.7 |
-3.5 |
0.284 |
6 |
3 |
0 |
0.000 |
3 |
10 |
|
E |
29 |
9 |
10898 |
◊ |
F |
-y,x-y,z-1/3 |
2_554 |
22 |
7 |
10952 |
223.6 |
-1.3 |
0.427 |
2 |
0 |
0 |
0.000 |
4 |
11 |
|
B |
23 |
10 |
10955 |
x |
B |
-y+1,x-y,z-1/3 |
2_654 |
20 |
8 |
10955 |
173.9 |
-0.2 |
0.553 |
0 |
0 |
0 |
0.000 |
5 |
12 |
|
[GOL]D:276 |
6 |
1 |
224 |
f |
D |
x,y,z |
1_555 |
28 |
12 |
10902 |
159.8 |
-1.1 |
0.476 |
2 |
0 |
0 |
0.084 |
13 |
|
[GOL]F:278 |
6 |
1 |
221 |
f |
F |
x,y,z |
1_555 |
27 |
12 |
10952 |
159.1 |
-1.0 |
0.482 |
2 |
0 |
0 |
0.084 |
14 |
|
[GOL]E:277 |
6 |
1 |
220 |
f |
E |
x,y,z |
1_555 |
27 |
12 |
10898 |
156.1 |
-1.0 |
0.476 |
2 |
0 |
0 |
0.084 |
15 |
|
[GOL]B:276 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
28 |
12 |
10955 |
155.4 |
-1.0 |
0.481 |
2 |
0 |
0 |
0.084 |
16 |
|
[GOL]C:277 |
6 |
1 |
219 |
f |
C |
x,y,z |
1_555 |
28 |
12 |
10948 |
154.6 |
-1.0 |
0.483 |
2 |
0 |
0 |
0.084 |
17 |
|
[GOL]A:276 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
25 |
12 |
10983 |
151.2 |
-1.0 |
0.498 |
2 |
0 |
0 |
0.084 |
Average: |
156.0 |
-1.0 |
0.483 |
2 |
0 |
0 |
0.084 |
6 |
18 |
|
[GOL]A:275 |
6 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
10983 |
120.8 |
-0.8 |
0.499 |
1 |
0 |
0 |
0.051 |
19 |
|
[GOL]E:276 |
6 |
1 |
218 |
f |
E |
x,y,z |
1_555 |
17 |
7 |
10898 |
119.9 |
-1.0 |
0.483 |
2 |
0 |
0 |
0.051 |
20 |
|
[GOL]D:274 |
6 |
1 |
220 |
f |
D |
x,y,z |
1_555 |
17 |
7 |
10902 |
119.7 |
-0.7 |
0.528 |
2 |
0 |
0 |
0.051 |
21 |
|
[GOL]B:274 |
6 |
1 |
217 |
f |
B |
x,y,z |
1_555 |
17 |
7 |
10955 |
118.0 |
-0.5 |
0.505 |
1 |
0 |
0 |
0.051 |
Average: |
119.6 |
-0.8 |
0.504 |
2 |
0 |
0 |
0.051 |
7 |
22 |
|
[GOL]F:277 |
6 |
1 |
223 |
f |
F |
x,y,z |
1_555 |
17 |
6 |
10952 |
119.3 |
0.9 |
0.704 |
4 |
0 |
0 |
0.013 |
8 |
23 |
|
[GOL]C:276 |
6 |
1 |
217 |
f |
C |
x,y,z |
1_555 |
18 |
7 |
10948 |
118.2 |
-1.1 |
0.470 |
2 |
0 |
0 |
0.026 |
9 |
24 |
|
[GOL]F:276 |
6 |
1 |
217 |
f |
F |
x,y,z |
1_555 |
14 |
7 |
10952 |
117.6 |
-0.7 |
0.496 |
2 |
0 |
0 |
0.023 |
10 |
25 |
|
[ACT]D:272 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
20 |
11 |
10902 |
114.3 |
-0.9 |
0.549 |
3 |
0 |
0 |
0.093 |
26 |
|
[ACT]C:272 |
4 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
15 |
10 |
10948 |
113.9 |
-0.9 |
0.525 |
2 |
0 |
0 |
0.093 |
27 |
|
[ACT]E:272 |
4 |
1 |
184 |
f |
E |
x,y,z |
1_555 |
19 |
11 |
10898 |
113.6 |
-1.0 |
0.570 |
2 |
0 |
0 |
0.093 |
28 |
|
[ACT]A:272 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
19 |
10 |
10983 |
113.3 |
-1.0 |
0.564 |
3 |
0 |
0 |
0.093 |
29 |
|
[ACT]F:272 |
4 |
1 |
183 |
f |
F |
x,y,z |
1_555 |
18 |
10 |
10952 |
112.9 |
-0.9 |
0.564 |
3 |
0 |
0 |
0.093 |
Average: |
113.6 |
-0.9 |
0.554 |
3 |
0 |
0 |
0.093 |
11 |
30 |
|
[ACT]B:272 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
18 |
10 |
10955 |
113.6 |
-0.9 |
0.534 |
3 |
0 |
0 |
0.031 |
12 |
31 |
|
[ACT]C:274 |
4 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
17 |
8 |
10948 |
113.1 |
-1.2 |
0.459 |
0 |
0 |
0 |
0.017 |
13 |
32 |
|
[ACT]F:274 |
4 |
1 |
185 |
f |
F |
x,y,z |
1_555 |
13 |
8 |
10952 |
110.9 |
-0.9 |
0.473 |
0 |
0 |
0 |
0.025 |
33 |
|
[ACT]E:274 |
4 |
1 |
184 |
f |
E |
x,y,z |
1_555 |
17 |
8 |
10898 |
109.8 |
-0.8 |
0.561 |
0 |
0 |
0 |
0.025 |
Average: |
110.3 |
-0.8 |
0.517 |
0 |
0 |
0 |
0.025 |
14 |
34 |
|
[GOL]D:275 |
6 |
1 |
222 |
f |
D |
x,y,z |
1_555 |
15 |
6 |
10902 |
105.6 |
0.5 |
0.665 |
6 |
0 |
0 |
0.097 |
35 |
|
[GOL]B:275 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
10955 |
105.2 |
0.5 |
0.705 |
7 |
0 |
0 |
0.097 |
36 |
|
[GOL]A:274 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
10983 |
104.6 |
0.5 |
0.713 |
6 |
0 |
0 |
0.097 |
37 |
|
[GOL]E:275 |
6 |
1 |
218 |
f |
E |
x,y,z |
1_555 |
14 |
5 |
10898 |
103.4 |
0.5 |
0.695 |
6 |
0 |
0 |
0.097 |
38 |
|
[GOL]F:275 |
6 |
1 |
218 |
f |
F |
x,y,z |
1_555 |
15 |
6 |
10952 |
103.0 |
0.4 |
0.665 |
6 |
0 |
0 |
0.097 |
39 |
|
[GOL]C:275 |
6 |
1 |
218 |
f |
C |
x,y,z |
1_555 |
14 |
5 |
10948 |
102.6 |
0.5 |
0.695 |
5 |
0 |
0 |
0.097 |
Average: |
104.1 |
0.5 |
0.690 |
6 |
0 |
0 |
0.097 |
15 |
40 |
|
[ACT]F:273 |
4 |
1 |
183 |
f |
F |
x,y,z |
1_555 |
12 |
5 |
10952 |
81.0 |
0.6 |
0.781 |
2 |
0 |
0 |
0.004 |
16 |
41 |
|
[GOL]D:275 |
5 |
1 |
222 |
◊ |
E |
x,y,z |
1_555 |
14 |
4 |
10898 |
75.0 |
-0.6 |
0.471 |
1 |
0 |
0 |
0.046 |
42 |
|
[GOL]B:275 |
5 |
1 |
220 |
◊ |
A |
x,y,z |
1_555 |
16 |
4 |
10983 |
73.6 |
-0.6 |
0.521 |
1 |
0 |
0 |
0.046 |
43 |
|
[GOL]C:275 |
5 |
1 |
218 |
◊ |
B |
x,y,z |
1_555 |
14 |
4 |
10955 |
73.5 |
-0.6 |
0.483 |
1 |
0 |
0 |
0.046 |
44 |
|
[GOL]A:274 |
5 |
1 |
220 |
◊ |
C |
x,y,z |
1_555 |
16 |
4 |
10948 |
73.2 |
-0.6 |
0.519 |
1 |
0 |
0 |
0.046 |
45 |
|
[GOL]E:275 |
5 |
1 |
218 |
◊ |
F |
x,y,z |
1_555 |
14 |
4 |
10952 |
72.8 |
-0.6 |
0.497 |
1 |
0 |
0 |
0.046 |
46 |
|
[GOL]F:275 |
5 |
1 |
218 |
◊ |
D |
x,y,z |
1_555 |
14 |
4 |
10902 |
72.1 |
-0.6 |
0.507 |
1 |
0 |
0 |
0.046 |
Average: |
73.4 |
-0.6 |
0.500 |
1 |
0 |
0 |
0.046 |
17 |
47 |
|
A |
10 |
4 |
10983 |
◊ |
B |
-y+1,x-y,z-1/3 |
2_654 |
6 |
2 |
10955 |
70.8 |
0.3 |
0.694 |
1 |
0 |
0 |
0.000 |
18 |
48 |
|
[GOL]C:278 |
5 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
8 |
3 |
10948 |
62.4 |
0.6 |
0.728 |
2 |
0 |
0 |
0.000 |
19 |
49 |
|
[GOL]C:278 |
6 |
1 |
216 |
f |
A |
-y+1,x-y,z-1/3 |
2_654 |
6 |
3 |
10983 |
61.0 |
0.5 |
0.716 |
2 |
0 |
0 |
0.005 |
20 |
50 |
|
E |
4 |
3 |
10898 |
◊ |
D |
-y,x-y,z-1/3 |
2_554 |
8 |
6 |
10902 |
53.6 |
2.5 |
0.923 |
0 |
0 |
0 |
0.000 |
21 |
51 |
|
[SO4]C:273 |
4 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
4 |
2 |
10948 |
51.7 |
-5.1 |
0.958 |
2 |
0 |
0 |
0.082 |
22 |
52 |
|
C |
10 |
4 |
10948 |
◊ |
A |
-y+1,x-y,z-1/3 |
2_654 |
4 |
2 |
10983 |
50.2 |
1.2 |
0.772 |
2 |
0 |
0 |
0.000 |
23 |
53 |
|
[SO4]B:273 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
10955 |
48.4 |
-4.7 |
0.972 |
2 |
0 |
0 |
0.075 |
24 |
54 |
|
[SO4]A:273 |
4 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
5 |
2 |
10983 |
48.1 |
-4.5 |
0.970 |
2 |
0 |
0 |
0.073 |
25 |
55 |
|
[SO4]E:273 |
4 |
1 |
184 |
f |
E |
x,y,z |
1_555 |
4 |
2 |
10898 |
48.0 |
-4.7 |
0.967 |
1 |
0 |
0 |
0.075 |
26 |
56 |
|
[SO4]D:273 |
4 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
4 |
2 |
10902 |
47.9 |
-4.6 |
0.977 |
2 |
0 |
0 |
0.080 |
27 |
57 |
|
F |
7 |
2 |
10952 |
◊ |
E |
-y,x-y,z-1/3 |
2_554 |
3 |
1 |
10898 |
45.4 |
-1.2 |
0.159 |
0 |
0 |
0 |
0.000 |
28 |
58 |
|
[GOL]B:276 |
1 |
1 |
220 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
10983 |
5.9 |
-0.0 |
0.369 |
0 |
0 |
0 |
0.000 |
59 |
|
[GOL]D:276 |
1 |
1 |
224 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
10898 |
5.4 |
-0.0 |
0.380 |
0 |
0 |
0 |
0.000 |
60 |
|
[GOL]C:277 |
1 |
1 |
219 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
10955 |
5.2 |
-0.0 |
0.383 |
0 |
0 |
0 |
0.000 |
61 |
|
[GOL]A:276 |
1 |
1 |
218 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
10948 |
4.8 |
-0.0 |
0.388 |
0 |
0 |
0 |
0.000 |
Average: |
5.3 |
-0.0 |
0.380 |
0 |
0 |
0 |
0.001 |
29 |
62 |
|
[GOL]E:277 |
1 |
1 |
220 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
10952 |
5.8 |
-0.0 |
0.383 |
0 |
0 |
0 |
0.000 |
63 |
|
[GOL]F:278 |
1 |
1 |
221 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
10902 |
5.6 |
-0.0 |
0.372 |
0 |
0 |
0 |
0.000 |
Average: |
5.7 |
-0.0 |
0.377 |
0 |
0 |
0 |
0.000 |
30 |
64 |
|
[GOL]F:277 |
1 |
1 |
223 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
10898 |
0.8 |
-0.0 |
0.515 |
0 |
0 |
0 |
0.000 |
|