| ## |
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 |
|
E |
216 |
62 |
12977 |
◊ |
D |
x,y,z |
1_555 |
208 |
57 |
12065 |
1925.7 |
-24.4 |
0.084 |
26 |
3 |
1 |
0.248 |
2 |
|
B |
131 |
35 |
6778 |
◊ |
A |
x,y,z |
1_555 |
136 |
41 |
15416 |
1274.3 |
-10.3 |
0.184 |
20 |
7 |
0 |
0.336 |
3 |
|
C |
54 |
9 |
1481 |
◊ |
A |
x,y,z |
1_555 |
119 |
35 |
15416 |
794.7 |
-11.5 |
0.382 |
15 |
0 |
0 |
0.413 |
4 |
|
E |
63 |
19 |
12977 |
x |
E |
-x-1,y-1/2,-z |
2_445 |
53 |
17 |
12977 |
551.9 |
-3.5 |
0.424 |
9 |
0 |
0 |
0.000 |
5 |
|
E |
47 |
16 |
12977 |
◊ |
A |
x,y,z |
1_555 |
43 |
12 |
15416 |
392.3 |
-3.0 |
0.339 |
4 |
4 |
0 |
0.051 |
6 |
|
A |
31 |
8 |
15416 |
◊ |
E |
-x,y-1/2,-z |
2_545 |
38 |
11 |
12977 |
325.6 |
-3.3 |
0.121 |
1 |
0 |
0 |
0.000 |
7 |
|
E |
38 |
9 |
12977 |
◊ |
A |
x,y,z-1 |
1_554 |
38 |
11 |
15416 |
315.2 |
-0.3 |
0.602 |
0 |
0 |
0 |
0.000 |
8 |
|
D |
32 |
11 |
12065 |
◊ |
A |
x,y,z |
1_555 |
40 |
12 |
15416 |
302.0 |
-2.3 |
0.379 |
4 |
0 |
0 |
0.028 |
9 |
|
E |
32 |
11 |
12977 |
◊ |
D |
-x-1,y-1/2,-z |
2_445 |
29 |
10 |
12065 |
274.1 |
3.1 |
0.921 |
4 |
2 |
0 |
0.000 |
10 |
|
B |
30 |
11 |
6778 |
◊ |
A |
-x-1,y-1/2,-z+1 |
2_446 |
33 |
10 |
15416 |
269.0 |
-1.8 |
0.426 |
1 |
0 |
0 |
0.000 |
11 |
|
A |
27 |
11 |
15416 |
x |
A |
-x,y-1/2,-z+1 |
2_546 |
30 |
9 |
15416 |
264.5 |
2.2 |
0.754 |
2 |
0 |
0 |
0.000 |
12 |
|
B |
24 |
7 |
6778 |
◊ |
A |
x,y-1,z |
1_545 |
32 |
8 |
15416 |
234.3 |
1.4 |
0.733 |
6 |
2 |
0 |
0.000 |
13 |
|
[7PE]A:504 |
17 |
1 |
604 |
◊ |
A |
x,y,z |
1_555 |
29 |
12 |
15416 |
233.4 |
3.9 |
0.591 |
5 |
0 |
0 |
0.000 |
14 |
|
D |
34 |
8 |
12065 |
◊ |
C |
x,y,z |
1_555 |
18 |
3 |
1481 |
213.5 |
-4.5 |
0.393 |
2 |
0 |
0 |
0.037 |
15 |
|
E |
30 |
10 |
12977 |
◊ |
C |
x,y,z |
1_555 |
18 |
5 |
1481 |
199.8 |
-1.4 |
0.657 |
4 |
0 |
0 |
0.030 |
16 |
|
[7PE]A:504 |
15 |
1 |
604 |
f |
B |
x,y,z |
1_555 |
21 |
7 |
6778 |
168.5 |
-2.0 |
0.210 |
1 |
0 |
0 |
0.041 |
17 |
|
E |
11 |
3 |
12977 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
23 |
9 |
12065 |
140.4 |
0.8 |
0.791 |
1 |
0 |
0 |
0.000 |
18 |
|
A |
15 |
4 |
15416 |
◊ |
D |
-x,y-1/2,-z+1 |
2_546 |
19 |
5 |
12065 |
140.3 |
1.0 |
0.719 |
3 |
2 |
0 |
0.000 |
19 |
|
A |
14 |
7 |
15416 |
◊ |
D |
x,y-1,z |
1_545 |
18 |
5 |
12065 |
137.9 |
-1.7 |
0.262 |
2 |
0 |
0 |
0.000 |
20 |
|
[GOL]E:607 |
6 |
1 |
218 |
f |
E |
x,y,z |
1_555 |
21 |
8 |
12977 |
135.8 |
-1.4 |
0.447 |
2 |
0 |
0 |
0.022 |
21 |
|
[PGE]A:501 |
9 |
1 |
335 |
◊ |
A |
x,y,z |
1_555 |
21 |
7 |
15416 |
135.2 |
2.0 |
0.129 |
2 |
0 |
0 |
0.000 |
22 |
|
[GOL]B:601 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
18 |
8 |
6778 |
134.0 |
-0.6 |
0.531 |
6 |
0 |
0 |
0.054 |
23 |
|
A |
20 |
6 |
15416 |
◊ |
[PGE]E:503 |
-x,y-1/2,-z |
2_545 |
10 |
1 |
330 |
130.4 |
2.3 |
0.116 |
2 |
0 |
0 |
0.000 |
24 |
|
[PGE]A:501 |
9 |
1 |
335 |
◊ |
E |
-x,y-1/2,-z |
2_545 |
17 |
6 |
12977 |
130.4 |
4.7 |
0.362 |
1 |
0 |
0 |
0.000 |
25 |
|
A |
11 |
3 |
15416 |
◊ |
D |
x,y-1,z+1 |
1_546 |
14 |
7 |
12065 |
127.3 |
-1.8 |
0.212 |
1 |
2 |
0 |
0.000 |
26 |
|
[GOL]B:603 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
21 |
9 |
6778 |
125.3 |
0.2 |
0.592 |
5 |
0 |
0 |
0.033 |
27 |
|
[GOL]D:606 |
6 |
1 |
218 |
f |
D |
x,y,z |
1_555 |
17 |
7 |
12065 |
118.8 |
-0.4 |
0.569 |
6 |
0 |
0 |
0.021 |
28 |
|
[GOL]A:605 |
6 |
1 |
222 |
◊ |
A |
x,y,z |
1_555 |
16 |
5 |
15416 |
113.4 |
0.5 |
0.581 |
2 |
0 |
0 |
0.004 |
29 |
|
[SO4]D:401 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
17 |
8 |
12065 |
111.2 |
-18.3 |
0.614 |
2 |
0 |
0 |
0.134 |
30 |
|
[SO4]E:406 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
22 |
8 |
12977 |
110.9 |
-16.2 |
0.714 |
3 |
0 |
0 |
0.166 |
31 |
|
[PGE]A:502 |
7 |
1 |
332 |
◊ |
A |
x,y,z |
1_555 |
21 |
8 |
15416 |
107.8 |
3.0 |
0.321 |
1 |
0 |
0 |
0.000 |
32 |
|
[GOL]E:604 |
6 |
1 |
224 |
f |
E |
x,y,z |
1_555 |
21 |
6 |
12977 |
107.3 |
-0.5 |
0.503 |
4 |
0 |
0 |
0.022 |
33 |
|
[PGE]E:503 |
9 |
1 |
330 |
◊ |
E |
x,y,z |
1_555 |
14 |
4 |
12977 |
105.8 |
1.5 |
0.111 |
1 |
0 |
0 |
0.000 |
34 |
|
[SO4]D:404 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
17 |
6 |
12065 |
105.3 |
-14.5 |
0.735 |
1 |
0 |
0 |
0.104 |
35 |
|
[GOL]B:609 |
6 |
1 |
221 |
◊ |
B |
x,y,z |
1_555 |
19 |
9 |
6778 |
103.5 |
0.1 |
0.605 |
4 |
0 |
0 |
0.029 |
36 |
|
[SO4]E:403 |
5 |
1 |
184 |
f |
E |
x,y,z |
1_555 |
20 |
8 |
12977 |
101.1 |
-15.2 |
0.737 |
1 |
0 |
0 |
0.148 |
37 |
|
[PGE]A:502 |
7 |
1 |
332 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
6778 |
90.5 |
1.5 |
0.197 |
1 |
0 |
0 |
0.000 |
38 |
|
[SO4]E:402 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
14 |
5 |
12977 |
89.3 |
-11.8 |
0.924 |
2 |
0 |
0 |
0.120 |
39 |
|
[GOL]E:611 |
5 |
1 |
218 |
f |
E |
x,y,z |
1_555 |
13 |
5 |
12977 |
88.4 |
-0.2 |
0.550 |
3 |
0 |
0 |
0.015 |
40 |
|
[SO4]A:407 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
15416 |
87.7 |
-11.9 |
0.829 |
0 |
0 |
0 |
0.271 |
41 |
|
[SO4]A:405 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
16 |
3 |
15416 |
86.6 |
-12.7 |
0.688 |
1 |
0 |
0 |
0.297 |
42 |
|
[SO4]D:409 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
13 |
6 |
12065 |
84.0 |
-12.5 |
0.802 |
3 |
0 |
0 |
0.097 |
43 |
|
[GOL]A:602 |
6 |
1 |
220 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
15416 |
84.0 |
-0.3 |
0.516 |
3 |
0 |
0 |
0.012 |
44 |
|
A |
10 |
3 |
15416 |
◊ |
E |
x,y-1,z+1 |
1_546 |
9 |
2 |
12977 |
83.4 |
-0.7 |
0.451 |
0 |
1 |
0 |
0.000 |
45 |
|
[GOL]E:608 |
6 |
1 |
217 |
◊ |
E |
x,y,z |
1_555 |
17 |
5 |
12977 |
82.4 |
-0.2 |
0.583 |
2 |
0 |
0 |
0.007 |
46 |
|
[GOL]B:609 |
5 |
1 |
221 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
15416 |
82.3 |
-1.5 |
0.286 |
2 |
0 |
0 |
0.053 |
47 |
|
[SO4]B:408 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
16 |
4 |
6778 |
72.7 |
-9.9 |
0.794 |
0 |
0 |
0 |
0.165 |
48 |
|
[GOL]A:602 |
5 |
1 |
220 |
f |
D |
x,y,z |
1_555 |
6 |
2 |
12065 |
71.9 |
-1.2 |
0.275 |
1 |
0 |
0 |
0.012 |
49 |
|
[GOL]E:611 |
5 |
1 |
218 |
◊ |
D |
x,y,z |
1_555 |
9 |
4 |
12065 |
67.6 |
-0.4 |
0.507 |
1 |
0 |
0 |
0.005 |
50 |
|
E |
13 |
4 |
12977 |
◊ |
[GOL]E:604 |
-x-1,y-1/2,-z |
2_445 |
5 |
1 |
224 |
67.2 |
-0.5 |
0.510 |
0 |
0 |
0 |
0.000 |
51 |
|
[GOL]E:608 |
5 |
1 |
217 |
f |
D |
x,y,z |
1_555 |
7 |
3 |
12065 |
64.2 |
-0.7 |
0.437 |
1 |
0 |
0 |
0.008 |
52 |
|
[GOL]A:605 |
4 |
1 |
222 |
f |
E |
x,y,z |
1_555 |
8 |
4 |
12977 |
63.3 |
0.8 |
0.723 |
3 |
0 |
0 |
0.005 |
53 |
|
[GOL]A:610 |
5 |
1 |
223 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
6778 |
61.0 |
-0.0 |
0.565 |
1 |
0 |
0 |
0.008 |
54 |
|
[GOL]A:610 |
4 |
1 |
223 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
15416 |
53.2 |
0.0 |
0.477 |
0 |
0 |
0 |
0.000 |
55 |
|
[SO4]D:404 |
3 |
1 |
186 |
◊ |
E |
x,y,z |
1_555 |
5 |
3 |
12977 |
44.3 |
-6.3 |
0.456 |
0 |
0 |
0 |
0.039 |
56 |
|
E |
3 |
1 |
12977 |
◊ |
[GOL]D:606 |
-x,y-1/2,-z |
2_545 |
4 |
1 |
218 |
42.6 |
-0.3 |
0.516 |
0 |
0 |
0 |
0.000 |
57 |
|
B |
3 |
1 |
6778 |
x |
B |
-x-1,y-1/2,-z+1 |
2_446 |
6 |
3 |
6778 |
42.5 |
0.7 |
0.799 |
0 |
0 |
0 |
0.000 |
58 |
|
A |
6 |
2 |
15416 |
◊ |
D |
-x-1,y-1/2,-z |
2_445 |
5 |
3 |
12065 |
41.2 |
-0.1 |
0.524 |
0 |
0 |
0 |
0.000 |
59 |
|
[GOL]B:601 |
2 |
1 |
220 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
15416 |
37.4 |
0.4 |
0.691 |
0 |
0 |
0 |
0.000 |
60 |
|
[SO4]D:409 |
3 |
1 |
185 |
◊ |
E |
x,y,z |
1_555 |
4 |
1 |
12977 |
37.3 |
-3.9 |
0.841 |
0 |
0 |
0 |
0.024 |
61 |
|
[SO4]E:403 |
3 |
1 |
184 |
◊ |
D |
x,y,z |
1_555 |
6 |
3 |
12065 |
33.0 |
-4.3 |
0.786 |
0 |
0 |
0 |
0.026 |
62 |
|
[GOL]A:602 |
3 |
1 |
220 |
◊ |
C |
x,y,z |
1_555 |
5 |
3 |
1481 |
31.5 |
-0.4 |
0.585 |
0 |
0 |
0 |
0.003 |
63 |
|
E |
1 |
1 |
12977 |
◊ |
[GOL]E:611 |
-x-1,y-1/2,-z |
2_445 |
3 |
1 |
218 |
25.8 |
-0.5 |
0.187 |
0 |
0 |
0 |
0.000 |
64 |
|
A |
2 |
1 |
15416 |
◊ |
[SO4]E:406 |
-x,y-1/2,-z |
2_545 |
3 |
1 |
185 |
25.3 |
-3.9 |
0.228 |
0 |
0 |
0 |
0.000 |
65 |
|
D |
1 |
1 |
12065 |
◊ |
A |
x,y,z-1 |
1_554 |
5 |
1 |
15416 |
21.7 |
0.7 |
0.691 |
0 |
0 |
0 |
0.000 |
66 |
|
[GOL]E:607 |
3 |
1 |
218 |
◊ |
D |
-x-1,y-1/2,-z |
2_445 |
6 |
1 |
12065 |
19.4 |
-0.0 |
0.617 |
0 |
0 |
0 |
0.000 |
67 |
|
[PGE]A:501 |
1 |
1 |
335 |
f |
[PGE]E:503 |
-x,y-1/2,-z |
2_545 |
2 |
1 |
330 |
14.6 |
0.5 |
0.239 |
0 |
0 |
0 |
0.000 |
68 |
|
[PGE]E:503 |
1 |
1 |
330 |
f |
A |
x,y,z-1 |
1_554 |
1 |
1 |
15416 |
14.1 |
1.0 |
0.619 |
0 |
0 |
0 |
0.000 |
69 |
|
[SO4]E:406 |
2 |
1 |
185 |
◊ |
A |
x,y,z-1 |
1_554 |
3 |
1 |
15416 |
12.3 |
-1.6 |
0.664 |
0 |
0 |
0 |
0.000 |
70 |
|
[SO4]E:402 |
1 |
1 |
185 |
◊ |
D |
-x-1,y-1/2,-z |
2_445 |
3 |
1 |
12065 |
11.2 |
-1.3 |
0.747 |
0 |
0 |
0 |
0.000 |
71 |
|
[GOL]A:610 |
1 |
1 |
223 |
f |
[7PE]A:504 |
x,y,z |
1_555 |
1 |
1 |
604 |
4.3 |
-0.0 |
0.488 |
0 |
0 |
0 |
0.000 |
|