| ## |
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 |
87 |
25 |
6936 |
◊ |
C |
y,x,-z |
4_555 |
87 |
25 |
6936 |
885.5 |
-4.6 |
0.313 |
11 |
2 |
0 |
0.152 |
2 |
|
E |
89 |
23 |
6721 |
◊ |
A |
y,x,-z |
4_555 |
83 |
24 |
7101 |
840.7 |
-1.3 |
0.552 |
15 |
3 |
0 |
0.152 |
| Average: |
863.1 |
-3.0 |
0.433 |
13 |
3 |
0 |
0.152 |
| 2 |
3 |
|
D |
64 |
17 |
6956 |
◊ |
A |
x,y,z |
1_555 |
52 |
14 |
7101 |
544.1 |
-3.5 |
0.280 |
8 |
1 |
0 |
0.093 |
4 |
|
E |
45 |
13 |
6721 |
◊ |
B |
x,y,z |
1_555 |
47 |
15 |
6859 |
404.2 |
-4.1 |
0.242 |
2 |
1 |
0 |
0.093 |
| Average: |
474.2 |
-3.8 |
0.261 |
5 |
1 |
0 |
0.093 |
| 3 |
5 |
|
F |
67 |
15 |
6760 |
◊ |
E |
x,y,z |
1_555 |
63 |
14 |
6721 |
539.2 |
-2.5 |
0.410 |
10 |
0 |
0 |
0.006 |
| 4 |
6 |
|
D |
66 |
15 |
6956 |
◊ |
C |
x,y,z |
1_555 |
63 |
15 |
6936 |
532.6 |
-1.4 |
0.474 |
12 |
0 |
0 |
0.107 |
7 |
|
B |
63 |
15 |
6859 |
◊ |
A |
x,y,z |
1_555 |
67 |
15 |
7101 |
524.8 |
-2.6 |
0.361 |
11 |
0 |
0 |
0.107 |
| Average: |
528.7 |
-2.0 |
0.418 |
12 |
0 |
0 |
0.107 |
| 5 |
8 |
|
B |
49 |
15 |
6859 |
◊ |
B |
-x,-x+y,-z+1/3 |
6_555 |
49 |
15 |
6859 |
442.3 |
-3.4 |
0.280 |
0 |
2 |
0 |
0.000 |
9 |
|
D |
50 |
15 |
6956 |
◊ |
F |
-x-1,-x+y-1,-z+1/3 |
6_445 |
50 |
15 |
6760 |
438.4 |
-3.0 |
0.300 |
1 |
2 |
0 |
0.000 |
| Average: |
440.4 |
-3.2 |
0.290 |
1 |
2 |
0 |
0.000 |
| 6 |
10 |
|
F |
43 |
15 |
6760 |
◊ |
C |
x,y,z |
1_555 |
42 |
13 |
6936 |
423.9 |
-2.1 |
0.338 |
3 |
2 |
0 |
0.003 |
| 7 |
11 |
|
F |
44 |
14 |
6760 |
◊ |
D |
x-y-1,-y-1,-z+2/3 |
5_445 |
43 |
13 |
6956 |
398.3 |
-5.2 |
0.125 |
3 |
0 |
0 |
0.000 |
12 |
|
B |
36 |
9 |
6859 |
◊ |
B |
x-y,-y,-z+2/3 |
5_555 |
36 |
9 |
6859 |
360.4 |
-3.6 |
0.215 |
2 |
0 |
0 |
0.000 |
| Average: |
379.4 |
-4.4 |
0.170 |
3 |
0 |
0 |
0.000 |
| 8 |
13 |
|
C |
49 |
14 |
6936 |
◊ |
A |
x,y,z |
1_555 |
43 |
12 |
7101 |
378.5 |
-3.3 |
0.212 |
2 |
0 |
0 |
0.119 |
14 |
|
E |
37 |
14 |
6721 |
◊ |
C |
x,y,z |
1_555 |
39 |
11 |
6936 |
344.1 |
-3.2 |
0.266 |
2 |
0 |
0 |
0.119 |
15 |
|
E |
39 |
11 |
6721 |
◊ |
A |
x,y,z |
1_555 |
38 |
15 |
7101 |
321.7 |
-3.7 |
0.171 |
0 |
0 |
0 |
0.119 |
| Average: |
348.1 |
-3.4 |
0.216 |
1 |
0 |
0 |
0.119 |
| 9 |
16 |
|
E |
27 |
8 |
6721 |
◊ |
C |
y,x,-z |
4_555 |
27 |
8 |
6936 |
235.6 |
-1.8 |
0.372 |
4 |
0 |
0 |
0.038 |
17 |
|
A |
28 |
8 |
7101 |
◊ |
A |
y,x,-z |
4_555 |
29 |
8 |
7101 |
224.4 |
-1.6 |
0.367 |
4 |
0 |
0 |
0.038 |
| Average: |
230.0 |
-1.7 |
0.369 |
4 |
0 |
0 |
0.038 |
| 10 |
18 |
|
[GOL]C:702 |
6 |
1 |
218 |
f |
C |
x,y,z |
1_555 |
25 |
11 |
6936 |
145.1 |
-0.5 |
0.530 |
2 |
0 |
0 |
0.032 |
| 11 |
19 |
|
[GOL]B:701 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
27 |
11 |
6859 |
140.1 |
-1.1 |
0.445 |
3 |
0 |
0 |
0.100 |
| 12 |
20 |
|
[GOL]D:701 |
6 |
1 |
215 |
f |
D |
x,y,z |
1_555 |
25 |
11 |
6956 |
139.8 |
-1.0 |
0.464 |
2 |
0 |
0 |
0.100 |
| 13 |
21 |
|
[GOL]C:703 |
6 |
1 |
216 |
f |
C |
x,y,z |
1_555 |
11 |
5 |
6936 |
87.4 |
0.1 |
0.556 |
4 |
0 |
0 |
0.038 |
| 14 |
22 |
|
[ACT]C:706 |
4 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
19 |
8 |
6936 |
86.6 |
-0.4 |
0.625 |
6 |
0 |
0 |
0.068 |
| 15 |
23 |
|
[SO4]E:702 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
13 |
4 |
6721 |
85.2 |
-11.5 |
0.902 |
3 |
0 |
0 |
0.233 |
| 16 |
24 |
|
[SO4]A:702 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
14 |
4 |
7101 |
84.4 |
-11.3 |
0.812 |
4 |
0 |
0 |
0.238 |
| 17 |
25 |
|
[SO4]C:704 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
10 |
4 |
6936 |
83.2 |
-10.7 |
0.919 |
3 |
0 |
0 |
0.270 |
| 18 |
26 |
|
[GOL]E:701 |
6 |
1 |
222 |
◊ |
E |
x,y,z |
1_555 |
15 |
6 |
6721 |
81.1 |
0.2 |
0.620 |
2 |
0 |
0 |
0.007 |
| 19 |
27 |
|
[SO4]F:701 |
5 |
1 |
187 |
f |
F |
x,y,z |
1_555 |
11 |
4 |
6760 |
78.7 |
-10.7 |
0.856 |
3 |
0 |
0 |
0.100 |
| 20 |
28 |
|
[GOL]C:701 |
4 |
1 |
216 |
f |
C |
x,y,z |
1_555 |
11 |
5 |
6936 |
78.4 |
-0.5 |
0.495 |
2 |
0 |
0 |
0.030 |
| 21 |
29 |
|
[GOL]C:701 |
6 |
1 |
216 |
◊ |
E |
x,y,z |
1_555 |
14 |
5 |
6721 |
71.6 |
-1.2 |
0.382 |
0 |
0 |
0 |
0.012 |
| 22 |
30 |
|
[GOL]E:701 |
5 |
1 |
222 |
f |
A |
x,y,z |
1_555 |
13 |
4 |
7101 |
70.6 |
-1.2 |
0.326 |
1 |
0 |
0 |
0.029 |
| 23 |
31 |
|
[ACT]A:703 |
4 |
1 |
183 |
f |
E |
y,x,-z |
4_555 |
11 |
3 |
6721 |
61.7 |
-0.5 |
0.635 |
1 |
0 |
0 |
0.018 |
| 24 |
32 |
|
[SO4]A:701 |
4 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
7101 |
61.2 |
-8.7 |
0.695 |
2 |
0 |
0 |
0.175 |
| 25 |
33 |
|
[SO4]C:705 |
4 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
7 |
4 |
6936 |
58.2 |
-6.2 |
0.945 |
3 |
0 |
0 |
0.168 |
| 26 |
34 |
|
[GOL]E:701 |
4 |
1 |
222 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
6859 |
48.3 |
0.2 |
0.509 |
1 |
0 |
0 |
0.002 |
| 27 |
35 |
|
[GOL]C:701 |
5 |
1 |
216 |
◊ |
F |
x,y,z |
1_555 |
6 |
3 |
6760 |
46.3 |
0.3 |
0.631 |
2 |
0 |
0 |
0.000 |
| 28 |
36 |
|
[ACT]C:706 |
3 |
1 |
184 |
◊ |
C |
y,x,-z |
4_555 |
7 |
3 |
6936 |
39.6 |
-0.8 |
0.501 |
0 |
0 |
0 |
0.018 |
| 29 |
37 |
|
[ACT]A:703 |
3 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
7101 |
38.9 |
1.0 |
0.809 |
1 |
0 |
0 |
0.000 |
| 30 |
38 |
|
[SO4]A:701 |
4 |
1 |
187 |
◊ |
E |
y,x,-z |
4_555 |
4 |
2 |
6721 |
38.1 |
-3.5 |
0.942 |
1 |
0 |
0 |
0.071 |
| 31 |
39 |
|
[SO4]A:701 |
3 |
1 |
187 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
6936 |
34.2 |
-3.9 |
0.893 |
1 |
0 |
0 |
0.043 |
| 32 |
40 |
|
[SO4]C:705 |
4 |
1 |
187 |
◊ |
C |
y,x,-z |
4_555 |
4 |
2 |
6936 |
33.4 |
-4.4 |
0.580 |
0 |
0 |
0 |
0.100 |
| 33 |
41 |
|
[SO4]C:704 |
3 |
1 |
185 |
◊ |
C |
y,x,-z |
4_555 |
2 |
1 |
6936 |
29.7 |
-2.4 |
0.979 |
2 |
0 |
0 |
0.073 |
| 34 |
42 |
|
[ACT]C:706 |
2 |
1 |
184 |
◊ |
[ACT]C:706 |
y,x,-z |
4_555 |
2 |
1 |
184 |
29.3 |
-0.9 |
0.500 |
0 |
0 |
0 |
0.011 |
| 35 |
43 |
|
[ACT]A:703 |
1 |
1 |
183 |
◊ |
A |
y,x,-z |
4_555 |
2 |
1 |
7101 |
28.7 |
0.6 |
0.904 |
1 |
0 |
0 |
0.000 |
| 36 |
44 |
|
[SO4]A:702 |
3 |
1 |
186 |
◊ |
E |
y,x,-z |
4_555 |
1 |
1 |
6721 |
28.4 |
-2.2 |
0.990 |
1 |
0 |
0 |
0.047 |
| 37 |
45 |
|
[SO4]C:704 |
1 |
1 |
185 |
◊ |
E |
x,y,z |
1_555 |
3 |
2 |
6721 |
27.6 |
-2.8 |
0.860 |
1 |
0 |
0 |
0.032 |
| 38 |
46 |
|
[SO4]E:702 |
3 |
1 |
185 |
◊ |
A |
y,x,-z |
4_555 |
1 |
1 |
7101 |
26.3 |
-2.2 |
0.989 |
1 |
0 |
0 |
0.047 |
| 39 |
47 |
|
[GOL]C:702 |
2 |
1 |
218 |
f |
[SO4]C:705 |
x,y,z |
1_555 |
3 |
1 |
187 |
26.1 |
-3.7 |
0.599 |
0 |
0 |
0 |
0.084 |
| 40 |
48 |
|
[SO4]E:702 |
3 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
7101 |
20.3 |
-1.6 |
0.963 |
1 |
0 |
0 |
0.020 |
| 41 |
49 |
|
[SO4]A:702 |
1 |
1 |
186 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
6936 |
15.8 |
-1.4 |
0.836 |
0 |
0 |
0 |
0.014 |
| 42 |
50 |
|
[SO4]E:702 |
2 |
1 |
185 |
◊ |
[SO4]C:704 |
x,y,z |
1_555 |
1 |
1 |
185 |
12.0 |
-2.9 |
0.876 |
0 |
0 |
0 |
0.029 |
| 43 |
51 |
|
[ACT]A:703 |
1 |
1 |
183 |
◊ |
B |
y,x,-z |
4_555 |
1 |
1 |
6859 |
11.3 |
0.0 |
0.651 |
0 |
0 |
0 |
0.000 |
| 44 |
52 |
|
[GOL]C:703 |
2 |
1 |
216 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
6760 |
10.7 |
0.1 |
0.698 |
0 |
0 |
0 |
0.000 |
| 45 |
53 |
|
[SO4]C:704 |
1 |
1 |
185 |
◊ |
[SO4]A:702 |
x,y,z |
1_555 |
1 |
1 |
186 |
10.1 |
-2.4 |
0.800 |
0 |
0 |
0 |
0.024 |
| 46 |
54 |
|
[SO4]E:702 |
1 |
1 |
185 |
◊ |
[SO4]A:702 |
x,y,z |
1_555 |
2 |
1 |
186 |
10.1 |
-2.4 |
0.876 |
0 |
0 |
0 |
0.024 |
|