| ## |
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 |
|
B |
121 |
33 |
12860 |
◊ |
A |
x,y,z |
1_555 |
123 |
31 |
12613 |
1144.6 |
-0.8 |
0.896 |
23 |
10 |
0 |
0.000 |
| 2 |
2 |
|
A |
69 |
21 |
12613 |
◊ |
B |
x,y,z-1 |
1_554 |
65 |
19 |
12860 |
607.2 |
-13.6 |
0.026 |
2 |
0 |
0 |
1.000 |
| 3 |
3 |
|
A |
60 |
22 |
12613 |
x |
A |
-x+1,y-1/2,-z |
2_645 |
66 |
20 |
12613 |
569.4 |
-4.1 |
0.528 |
5 |
4 |
0 |
0.000 |
| 4 |
4 |
|
B |
33 |
11 |
12860 |
◊ |
A |
x-1,y,z |
1_455 |
36 |
6 |
12613 |
331.2 |
-5.3 |
0.192 |
4 |
0 |
0 |
0.000 |
| 5 |
5 |
|
A |
24 |
10 |
12613 |
x |
A |
-x,y-1/2,-z |
2_545 |
24 |
9 |
12613 |
223.8 |
-3.2 |
0.279 |
2 |
0 |
0 |
0.000 |
| 6 |
6 |
|
B |
28 |
8 |
12860 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
21 |
9 |
12613 |
222.1 |
-3.5 |
0.237 |
3 |
0 |
0 |
0.000 |
| 7 |
7 |
|
[GOL]A:408 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
31 |
13 |
12613 |
147.0 |
-0.9 |
0.609 |
3 |
0 |
0 |
0.260 |
| 8 |
8 |
|
B |
16 |
6 |
12860 |
x |
B |
-x,y-1/2,-z+1 |
2_546 |
13 |
5 |
12860 |
136.2 |
-3.0 |
0.189 |
0 |
0 |
0 |
0.000 |
| 9 |
9 |
|
A |
17 |
6 |
12613 |
x |
A |
x-1,y,z |
1_455 |
12 |
6 |
12613 |
120.3 |
-2.3 |
0.230 |
0 |
0 |
0 |
0.000 |
| 10 |
10 |
|
[GOL]A:412 |
6 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
20 |
8 |
12613 |
119.6 |
-0.5 |
0.557 |
6 |
0 |
0 |
0.361 |
| 11 |
11 |
|
[EDO]A:411 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
20 |
8 |
12613 |
100.9 |
3.1 |
0.745 |
2 |
0 |
0 |
0.000 |
| 12 |
12 |
|
[GOL]A:407 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
16 |
5 |
12613 |
97.7 |
-0.1 |
0.587 |
3 |
0 |
0 |
0.162 |
| 13 |
13 |
|
[EDO]B:402 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
19 |
11 |
12860 |
97.1 |
3.1 |
0.535 |
5 |
0 |
0 |
0.000 |
| 14 |
14 |
|
[EDO]A:406 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
18 |
11 |
12613 |
96.4 |
3.0 |
0.530 |
5 |
0 |
0 |
0.000 |
| 15 |
15 |
|
[EOH]A:410 |
3 |
1 |
171 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
12613 |
94.8 |
2.3 |
0.241 |
1 |
0 |
0 |
0.000 |
| 16 |
16 |
|
[EDO]B:404 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
20 |
8 |
12860 |
92.9 |
2.7 |
0.503 |
3 |
0 |
0 |
0.000 |
| 17 |
17 |
|
B |
10 |
4 |
12860 |
◊ |
[EDO]A:409 |
-x+1,y-1/2,-z+1 |
2_646 |
4 |
1 |
184 |
85.0 |
2.9 |
0.496 |
2 |
0 |
0 |
0.000 |
| 18 |
18 |
|
[GOL]A:407 |
6 |
1 |
217 |
◊ |
B |
x,y,z |
1_555 |
15 |
4 |
12860 |
81.0 |
-0.1 |
0.605 |
3 |
0 |
0 |
0.000 |
| 19 |
19 |
|
[EOH]A:401 |
3 |
1 |
174 |
◊ |
B |
x,y,z-1 |
1_554 |
8 |
3 |
12860 |
74.9 |
1.8 |
0.115 |
1 |
0 |
0 |
0.000 |
| 20 |
20 |
|
[EDO]B:403 |
4 |
1 |
181 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
12860 |
69.9 |
1.5 |
0.271 |
0 |
0 |
0 |
0.000 |
| 21 |
21 |
|
[EOH]A:402 |
3 |
1 |
172 |
◊ |
B |
x,y,z |
1_555 |
10 |
6 |
12860 |
68.6 |
2.0 |
0.118 |
0 |
0 |
0 |
0.000 |
| 22 |
22 |
|
[EOH]A:401 |
3 |
1 |
174 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
12613 |
52.9 |
0.2 |
0.450 |
1 |
0 |
0 |
0.028 |
| 23 |
23 |
|
[EDO]A:409 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
12613 |
50.7 |
1.5 |
0.907 |
1 |
0 |
0 |
0.000 |
| 24 |
24 |
|
[EDO]B:404 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
7 |
2 |
12613 |
46.5 |
2.0 |
0.966 |
0 |
0 |
0 |
0.000 |
| 25 |
25 |
|
[EOH]A:402 |
3 |
1 |
172 |
f |
A |
x,y,z |
1_555 |
9 |
2 |
12613 |
46.0 |
1.0 |
0.826 |
1 |
0 |
0 |
0.000 |
| 26 |
26 |
|
[EDO]A:406 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
8 |
2 |
12860 |
45.4 |
1.3 |
0.756 |
0 |
0 |
0 |
0.000 |
27 |
|
[EDO]B:402 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
8 |
2 |
12613 |
44.2 |
1.3 |
0.774 |
0 |
0 |
0 |
0.000 |
| Average: |
44.8 |
1.3 |
0.765 |
0 |
0 |
0 |
0.000 |
| 27 |
28 |
|
[EDO]A:411 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
7 |
2 |
12860 |
45.4 |
2.4 |
0.984 |
1 |
0 |
0 |
0.000 |
| 28 |
29 |
|
[GOL]A:412 |
3 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
12860 |
42.0 |
-0.3 |
0.498 |
1 |
0 |
0 |
0.000 |
| 29 |
30 |
|
B |
3 |
1 |
12860 |
x |
B |
-x+1,y-1/2,-z+1 |
2_646 |
3 |
2 |
12860 |
38.7 |
-1.2 |
0.143 |
0 |
0 |
0 |
0.000 |
| 30 |
31 |
|
B |
8 |
4 |
12860 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
4 |
2 |
12613 |
36.4 |
-0.5 |
0.372 |
0 |
0 |
0 |
0.000 |
| 31 |
32 |
|
B |
5 |
3 |
12860 |
x |
B |
x-1,y,z |
1_455 |
4 |
3 |
12860 |
17.5 |
-0.0 |
0.638 |
0 |
0 |
0 |
0.000 |
| 32 |
33 |
|
[EDO]B:404 |
2 |
1 |
183 |
f |
[EDO]A:411 |
x,y,z |
1_555 |
2 |
1 |
183 |
8.7 |
0.5 |
1.000 |
0 |
0 |
0 |
0.000 |
| 33 |
34 |
|
[GOL]A:412 |
1 |
1 |
216 |
f |
[EDO]B:404 |
x,y,z |
1_555 |
1 |
1 |
183 |
1.2 |
0.0 |
0.707 |
0 |
0 |
0 |
0.000 |
|