## |
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 |
|
A |
83 |
27 |
44717 |
x |
A |
-x-1,y-1/2,-z+1/2 |
3_445 |
80 |
30 |
44717 |
704.5 |
-3.0 |
0.590 |
11 |
6 |
0 |
0.000 |
2 |
|
A |
54 |
18 |
44717 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
54 |
17 |
44717 |
445.3 |
-0.1 |
0.669 |
7 |
6 |
0 |
0.000 |
3 |
|
A |
43 |
14 |
44717 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
34 |
12 |
44717 |
309.0 |
-2.2 |
0.486 |
1 |
0 |
0 |
0.000 |
4 |
|
A |
31 |
10 |
44717 |
x |
A |
x-1,y,z |
1_455 |
34 |
10 |
44717 |
266.4 |
-0.1 |
0.648 |
4 |
1 |
0 |
0.000 |
5 |
|
[MES]A:4 |
12 |
1 |
339 |
◊ |
A |
x,y,z |
1_555 |
22 |
8 |
44717 |
183.6 |
3.3 |
0.097 |
0 |
0 |
0 |
0.000 |
6 |
|
[MES]A:2 |
11 |
1 |
340 |
f |
A |
x,y,z |
1_555 |
18 |
9 |
44717 |
133.9 |
3.3 |
0.060 |
0 |
0 |
0 |
0.000 |
7 |
|
[EDO]A:112 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
22 |
10 |
44717 |
126.0 |
3.7 |
0.674 |
3 |
0 |
0 |
0.000 |
8 |
|
[EDO]A:114 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
22 |
11 |
44717 |
120.4 |
3.2 |
0.546 |
7 |
0 |
0 |
0.000 |
9 |
|
[EDO]A:119 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
23 |
11 |
44717 |
119.9 |
4.6 |
0.768 |
5 |
0 |
0 |
0.000 |
10 |
|
[EDO]A:120 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
22 |
10 |
44717 |
115.2 |
3.0 |
0.503 |
3 |
0 |
0 |
0.000 |
11 |
|
[EDO]A:122 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
20 |
10 |
44717 |
115.1 |
3.0 |
0.399 |
1 |
0 |
0 |
0.000 |
12 |
|
[EDO]A:105 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
44717 |
114.1 |
2.9 |
0.494 |
1 |
0 |
0 |
0.000 |
13 |
|
[EDO]A:107 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
44717 |
112.8 |
2.0 |
0.327 |
1 |
0 |
0 |
0.000 |
14 |
|
[EDO]A:118 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
22 |
10 |
44717 |
112.5 |
2.7 |
0.421 |
3 |
0 |
0 |
0.000 |
15 |
|
[EDO]A:110 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
17 |
9 |
44717 |
112.1 |
5.1 |
0.589 |
5 |
0 |
0 |
0.000 |
16 |
|
[EDO]A:102 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
20 |
10 |
44717 |
110.0 |
4.0 |
0.677 |
5 |
0 |
0 |
0.000 |
17 |
|
[EDO]A:101 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
15 |
9 |
44717 |
107.6 |
2.6 |
0.362 |
1 |
0 |
0 |
0.000 |
18 |
|
[EDO]A:106 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
18 |
7 |
44717 |
106.9 |
4.0 |
0.684 |
4 |
0 |
0 |
0.000 |
19 |
|
[EDO]A:121 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
17 |
9 |
44717 |
106.8 |
3.1 |
0.443 |
0 |
0 |
0 |
0.000 |
20 |
|
[EDO]A:124 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
44717 |
104.0 |
1.7 |
0.311 |
0 |
0 |
0 |
0.000 |
21 |
|
[EDO]A:113 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
20 |
7 |
44717 |
103.1 |
2.9 |
0.482 |
2 |
0 |
0 |
0.000 |
22 |
|
[EDO]A:111 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
18 |
5 |
44717 |
100.7 |
2.9 |
0.425 |
0 |
0 |
0 |
0.000 |
23 |
|
[SO4]A:1 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
16 |
9 |
44717 |
100.1 |
-14.8 |
0.772 |
3 |
0 |
0 |
0.000 |
24 |
|
[EDO]A:103 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
8 |
44717 |
100.1 |
2.6 |
0.294 |
5 |
0 |
0 |
0.000 |
25 |
|
[EDO]A:109 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
44717 |
97.1 |
3.7 |
0.561 |
1 |
0 |
0 |
0.000 |
26 |
|
[EDO]A:108 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
44717 |
94.4 |
2.6 |
0.439 |
2 |
0 |
0 |
0.000 |
27 |
|
[EDO]A:115 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
15 |
6 |
44717 |
94.3 |
3.0 |
0.499 |
2 |
0 |
0 |
0.000 |
28 |
|
[EDO]A:116 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
44717 |
93.6 |
2.4 |
0.436 |
1 |
0 |
0 |
0.000 |
29 |
|
[EDO]A:125 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
17 |
8 |
44717 |
92.8 |
1.4 |
0.209 |
0 |
0 |
0 |
0.000 |
30 |
|
[EDO]A:117 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
44717 |
92.0 |
1.5 |
0.186 |
1 |
0 |
0 |
0.000 |
31 |
|
[EDO]A:104 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
44717 |
84.1 |
1.6 |
0.193 |
0 |
0 |
0 |
0.000 |
32 |
|
[EDO]A:123 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
44717 |
71.7 |
1.7 |
0.205 |
0 |
0 |
0 |
0.000 |
33 |
|
A |
7 |
4 |
44717 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
8 |
3 |
44717 |
62.3 |
-1.2 |
0.291 |
0 |
0 |
0 |
0.000 |
34 |
|
A |
4 |
2 |
44717 |
f |
[EDO]A:115 |
x-1,y,z |
1_455 |
4 |
1 |
184 |
54.6 |
2.1 |
0.959 |
1 |
0 |
0 |
0.000 |
35 |
|
[EDO]A:125 |
4 |
1 |
184 |
f |
[EDO]A:124 |
x,y,z |
1_555 |
4 |
1 |
186 |
38.4 |
1.2 |
1.000 |
1 |
0 |
0 |
0.000 |
36 |
|
A |
3 |
2 |
44717 |
f |
[MES]A:4 |
x-1/2,-y+1/2,-z |
4_455 |
3 |
1 |
339 |
37.7 |
0.7 |
0.223 |
0 |
0 |
0 |
0.000 |
37 |
|
[EDO]A:117 |
2 |
1 |
184 |
f |
[EDO]A:101 |
x,y,z |
1_555 |
2 |
1 |
186 |
31.1 |
1.5 |
1.000 |
0 |
0 |
0 |
0.000 |
38 |
|
[EDO]A:118 |
2 |
1 |
183 |
f |
[EDO]A:117 |
x,y,z |
1_555 |
3 |
1 |
184 |
29.7 |
1.6 |
0.707 |
0 |
0 |
0 |
0.000 |
39 |
|
[EDO]A:107 |
2 |
1 |
185 |
f |
[EDO]A:104 |
x,y,z |
1_555 |
3 |
1 |
186 |
24.2 |
0.7 |
1.000 |
1 |
0 |
0 |
0.000 |
40 |
|
[EDO]A:107 |
1 |
1 |
185 |
f |
[EDO]A:105 |
x,y,z |
1_555 |
2 |
1 |
185 |
20.7 |
0.7 |
1.000 |
1 |
0 |
0 |
0.000 |
41 |
|
[EDO]A:109 |
2 |
1 |
185 |
f |
[EDO]A:108 |
x,y,z |
1_555 |
2 |
1 |
186 |
19.0 |
0.8 |
1.000 |
0 |
0 |
0 |
0.000 |
42 |
|
[EDO]A:113 |
3 |
1 |
186 |
f |
[EDO]A:110 |
x,y,z |
1_555 |
2 |
1 |
183 |
17.7 |
0.6 |
1.000 |
1 |
0 |
0 |
0.000 |
43 |
|
[EDO]A:123 |
2 |
1 |
184 |
f |
[EDO]A:111 |
x,y,z |
1_555 |
1 |
1 |
185 |
4.1 |
0.2 |
1.000 |
0 |
0 |
0 |
0.000 |
|