| ## |
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 |
|
C |
273 |
70 |
16990 |
◊ |
A |
x,y,z |
1_555 |
269 |
69 |
16955 |
2776.7 |
-47.3 |
0.003 |
19 |
18 |
0 |
0.830 |
2 |
|
D |
267 |
67 |
16950 |
◊ |
B |
x,y,z |
1_555 |
279 |
70 |
16860 |
2757.4 |
-47.9 |
0.003 |
18 |
16 |
0 |
0.830 |
| Average: |
2767.1 |
-47.6 |
0.003 |
19 |
17 |
0 |
0.830 |
| 2 |
3 |
|
D |
140 |
43 |
16950 |
◊ |
A |
x,y,z |
1_555 |
133 |
36 |
16955 |
1354.2 |
-8.9 |
0.436 |
18 |
12 |
0 |
0.505 |
4 |
|
C |
137 |
42 |
16990 |
◊ |
B |
x,y,z |
1_555 |
128 |
36 |
16860 |
1334.2 |
-8.9 |
0.449 |
18 |
13 |
0 |
0.505 |
| Average: |
1344.2 |
-8.9 |
0.443 |
18 |
13 |
0 |
0.505 |
| 3 |
5 |
|
F |
116 |
25 |
5769 |
◊ |
E |
x,y,z |
1_555 |
114 |
25 |
5797 |
1114.6 |
-9.4 |
0.869 |
48 |
0 |
0 |
1.000 |
| 4 |
6 |
|
D |
68 |
18 |
16950 |
◊ |
C |
x,y,z |
1_555 |
70 |
18 |
16990 |
637.8 |
-14.1 |
0.033 |
1 |
0 |
0 |
0.571 |
| 5 |
7 |
|
B |
67 |
19 |
16860 |
◊ |
A |
x,y,z |
1_555 |
63 |
17 |
16955 |
574.8 |
2.3 |
0.848 |
7 |
1 |
0 |
0.004 |
| 6 |
8 |
|
E |
33 |
5 |
5797 |
◊ |
A |
x,y,z |
1_555 |
27 |
8 |
16955 |
274.0 |
-3.7 |
0.454 |
4 |
0 |
0 |
0.101 |
| 7 |
9 |
|
F |
36 |
6 |
5769 |
◊ |
B |
x,y,z |
1_555 |
29 |
8 |
16860 |
268.6 |
-3.3 |
0.514 |
2 |
0 |
0 |
0.045 |
| 8 |
10 |
|
E |
26 |
5 |
5797 |
◊ |
C |
x,y,z |
1_555 |
29 |
10 |
16990 |
256.8 |
-4.7 |
0.434 |
3 |
0 |
0 |
0.153 |
| 9 |
11 |
|
F |
28 |
6 |
5769 |
◊ |
C |
x,y,z |
1_555 |
27 |
9 |
16990 |
251.3 |
-6.0 |
0.390 |
2 |
0 |
0 |
0.181 |
| 10 |
12 |
|
F |
30 |
5 |
5769 |
◊ |
D |
x,y,z |
1_555 |
27 |
9 |
16950 |
251.3 |
-3.7 |
0.469 |
4 |
0 |
0 |
0.145 |
| 11 |
13 |
|
E |
28 |
6 |
5797 |
◊ |
D |
x,y,z |
1_555 |
26 |
8 |
16950 |
245.9 |
-5.8 |
0.372 |
4 |
0 |
0 |
0.193 |
| 12 |
14 |
|
E |
24 |
5 |
5797 |
◊ |
B |
x,y,z |
1_555 |
31 |
9 |
16860 |
239.6 |
-6.6 |
0.288 |
1 |
0 |
0 |
0.139 |
| 13 |
15 |
|
F |
22 |
6 |
5769 |
◊ |
A |
x,y,z |
1_555 |
23 |
7 |
16955 |
208.6 |
-5.4 |
0.306 |
1 |
0 |
0 |
0.071 |
| 14 |
16 |
|
D |
20 |
8 |
16950 |
◊ |
B |
x-1,y,z-1 |
1_454 |
21 |
6 |
16860 |
166.9 |
0.9 |
0.759 |
2 |
0 |
0 |
0.000 |
17 |
|
A |
19 |
5 |
16955 |
◊ |
C |
x-1,y,z-1 |
1_454 |
17 |
8 |
16990 |
149.4 |
0.9 |
0.755 |
2 |
0 |
0 |
0.000 |
| Average: |
158.1 |
0.9 |
0.757 |
2 |
0 |
0 |
0.000 |
| 15 |
18 |
|
C |
26 |
7 |
16990 |
◊ |
D |
-x+1,y-1/2,-z+3 |
2_648 |
16 |
5 |
16950 |
164.3 |
-1.7 |
0.474 |
1 |
3 |
0 |
0.000 |
19 |
|
C |
16 |
6 |
16990 |
◊ |
D |
-x,y-1/2,-z+2 |
2_547 |
16 |
5 |
16950 |
149.5 |
-0.5 |
0.601 |
0 |
0 |
0 |
0.000 |
| Average: |
156.9 |
-1.1 |
0.537 |
1 |
2 |
0 |
0.000 |
| 16 |
20 |
|
[GOL]C:301 |
6 |
1 |
220 |
f |
C |
x,y,z |
1_555 |
26 |
14 |
16990 |
143.4 |
-1.0 |
0.540 |
0 |
0 |
0 |
0.047 |
| 17 |
21 |
|
[GOL]D:301 |
6 |
1 |
218 |
f |
D |
x,y,z |
1_555 |
24 |
13 |
16950 |
141.0 |
-1.2 |
0.530 |
0 |
0 |
0 |
0.048 |
| 18 |
22 |
|
[MPD]A:302 |
7 |
1 |
282 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
16955 |
127.9 |
-7.6 |
0.794 |
1 |
0 |
0 |
0.212 |
23 |
|
[MPD]B:303 |
7 |
1 |
281 |
f |
B |
x,y,z |
1_555 |
15 |
7 |
16860 |
125.1 |
-7.5 |
0.789 |
1 |
0 |
0 |
0.212 |
| Average: |
126.5 |
-7.5 |
0.791 |
1 |
0 |
0 |
0.212 |
| 19 |
24 |
|
[MPD]B:304 |
6 |
1 |
281 |
f |
D |
x,y,z |
1_555 |
18 |
6 |
16950 |
125.2 |
-7.6 |
0.752 |
0 |
0 |
0 |
0.298 |
| 20 |
25 |
|
[MPD]B:304 |
7 |
1 |
281 |
◊ |
B |
x,y,z |
1_555 |
19 |
5 |
16860 |
111.4 |
-5.7 |
0.878 |
1 |
0 |
0 |
0.072 |
| 21 |
26 |
|
A |
12 |
4 |
16955 |
◊ |
B |
-x,y-1/2,-z+2 |
2_547 |
12 |
5 |
16860 |
108.9 |
2.6 |
0.902 |
3 |
6 |
0 |
0.000 |
27 |
|
A |
13 |
6 |
16955 |
◊ |
B |
-x+1,y-1/2,-z+3 |
2_648 |
16 |
4 |
16860 |
98.1 |
1.5 |
0.813 |
2 |
4 |
0 |
0.000 |
| Average: |
103.5 |
2.0 |
0.857 |
3 |
5 |
0 |
0.000 |
| 22 |
28 |
|
A |
13 |
5 |
16955 |
◊ |
B |
-x,y-1/2,-z+3 |
2_548 |
13 |
3 |
16860 |
105.1 |
1.4 |
0.808 |
1 |
1 |
0 |
0.000 |
| 23 |
29 |
|
[GOL]A:301 |
5 |
1 |
220 |
f |
C |
x,y,z |
1_555 |
17 |
7 |
16990 |
94.9 |
-0.7 |
0.517 |
1 |
0 |
0 |
0.053 |
| 24 |
30 |
|
[GOL]A:301 |
6 |
1 |
220 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
16955 |
89.3 |
0.4 |
0.696 |
2 |
0 |
0 |
0.007 |
| 25 |
31 |
|
[GOL]D:302 |
6 |
1 |
215 |
◊ |
D |
x,y,z |
1_555 |
11 |
5 |
16950 |
89.3 |
0.3 |
0.703 |
0 |
0 |
0 |
0.000 |
| 26 |
32 |
|
[GOL]B:302 |
5 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
11 |
3 |
16860 |
87.1 |
-0.1 |
0.604 |
2 |
0 |
0 |
0.026 |
| 27 |
33 |
|
[GOL]C:302 |
5 |
1 |
214 |
f |
B |
x,y,z |
1_555 |
16 |
5 |
16860 |
86.1 |
-0.8 |
0.550 |
1 |
0 |
0 |
0.033 |
| 28 |
34 |
|
[GOL]C:302 |
6 |
1 |
214 |
◊ |
C |
x,y,z |
1_555 |
9 |
4 |
16990 |
84.9 |
0.4 |
0.714 |
0 |
0 |
0 |
0.000 |
| 29 |
35 |
|
[GOL]B:301 |
6 |
1 |
217 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
16860 |
84.6 |
-1.6 |
0.392 |
0 |
0 |
0 |
0.042 |
| 30 |
36 |
|
[GOL]D:302 |
5 |
1 |
215 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
16955 |
82.0 |
-0.8 |
0.557 |
1 |
0 |
0 |
0.029 |
| 31 |
37 |
|
[GOL]B:302 |
4 |
1 |
220 |
◊ |
D |
x,y,z |
1_555 |
14 |
4 |
16950 |
81.7 |
-0.3 |
0.550 |
0 |
0 |
0 |
0.004 |
| 32 |
38 |
|
[MPD]B:303 |
3 |
1 |
281 |
◊ |
C |
x,y,z |
1_555 |
14 |
4 |
16990 |
79.9 |
-5.0 |
0.628 |
0 |
0 |
0 |
0.135 |
39 |
|
[MPD]A:302 |
3 |
1 |
282 |
◊ |
D |
x,y,z |
1_555 |
16 |
4 |
16950 |
78.1 |
-4.9 |
0.640 |
0 |
0 |
0 |
0.135 |
| Average: |
79.0 |
-5.0 |
0.634 |
0 |
0 |
0 |
0.135 |
| 33 |
40 |
|
A |
9 |
4 |
16955 |
◊ |
D |
-x,y-1/2,-z+2 |
2_547 |
9 |
4 |
16950 |
61.8 |
0.1 |
0.669 |
1 |
1 |
0 |
0.000 |
41 |
|
C |
8 |
3 |
16990 |
◊ |
B |
-x+1,y-1/2,-z+3 |
2_648 |
7 |
3 |
16860 |
57.9 |
0.4 |
0.719 |
1 |
2 |
0 |
0.000 |
| Average: |
59.9 |
0.3 |
0.694 |
1 |
2 |
0 |
0.000 |
| 34 |
42 |
|
E |
4 |
2 |
5797 |
◊ |
C |
x,y,z-1 |
1_554 |
6 |
3 |
16990 |
49.8 |
-0.4 |
0.430 |
0 |
0 |
0 |
0.000 |
| 35 |
43 |
|
C |
5 |
2 |
16990 |
◊ |
E |
-x+1,y-1/2,-z+3 |
2_648 |
6 |
1 |
5797 |
39.4 |
0.1 |
0.594 |
1 |
0 |
0 |
0.000 |
| 36 |
44 |
|
A |
6 |
2 |
16955 |
◊ |
D |
-x-1,y-1/2,-z+2 |
2_447 |
5 |
2 |
16950 |
31.5 |
-0.2 |
0.576 |
0 |
0 |
0 |
0.000 |
| 37 |
45 |
|
A |
4 |
2 |
16955 |
◊ |
E |
-x,y-1/2,-z+2 |
2_547 |
2 |
1 |
5797 |
25.0 |
-0.8 |
0.421 |
1 |
0 |
0 |
0.000 |
| 38 |
46 |
|
F |
2 |
2 |
5769 |
◊ |
B |
-x+1,y-1/2,-z+3 |
2_648 |
3 |
1 |
16860 |
22.1 |
-1.0 |
0.408 |
1 |
0 |
0 |
0.000 |
| 39 |
47 |
|
F |
5 |
2 |
5769 |
◊ |
C |
x,y,z-1 |
1_554 |
3 |
1 |
16990 |
21.5 |
-0.1 |
0.641 |
0 |
0 |
0 |
0.000 |
| 40 |
48 |
|
E |
2 |
1 |
5797 |
◊ |
B |
-x+1,y-1/2,-z+3 |
2_648 |
3 |
1 |
16860 |
19.0 |
-0.8 |
0.433 |
0 |
0 |
0 |
0.000 |
| 41 |
49 |
|
D |
4 |
3 |
16950 |
◊ |
E |
x-1,y,z |
1_455 |
2 |
2 |
5797 |
18.9 |
-0.9 |
0.413 |
0 |
0 |
0 |
0.000 |
| 42 |
50 |
|
F |
1 |
1 |
5769 |
◊ |
D |
-x,y-1/2,-z+2 |
2_547 |
1 |
1 |
16950 |
9.8 |
-0.2 |
0.403 |
0 |
0 |
0 |
0.000 |
| 43 |
51 |
|
D |
1 |
1 |
16950 |
◊ |
B |
-x,y-1/2,-z+3 |
2_548 |
1 |
1 |
16860 |
2.9 |
0.1 |
0.794 |
0 |
0 |
0 |
0.000 |
| 44 |
52 |
|
A |
1 |
1 |
16955 |
◊ |
F |
-x,y-1/2,-z+2 |
2_547 |
1 |
1 |
5769 |
1.1 |
-0.1 |
0.409 |
0 |
0 |
0 |
0.000 |
|