## |
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 |
110 |
26 |
12266 |
◊ |
A |
x,y,z |
1_555 |
119 |
29 |
12200 |
1020.6 |
-20.0 |
0.030 |
2 |
0 |
0 |
1.000 |
2 |
2 |
|
A |
49 |
14 |
12200 |
◊ |
B |
-x-1,y-1/2,-z-1/2 |
3_444 |
56 |
17 |
12266 |
506.2 |
-6.5 |
0.247 |
1 |
0 |
0 |
0.000 |
3 |
3 |
|
[GSH]B:301 |
20 |
1 |
515 |
f |
B |
x,y,z |
1_555 |
48 |
20 |
12266 |
333.3 |
-4.5 |
0.696 |
11 |
0 |
0 |
1.000 |
4 |
|
[GSH]A:301 |
20 |
1 |
514 |
f |
A |
x,y,z |
1_555 |
44 |
20 |
12200 |
311.0 |
-4.7 |
0.629 |
10 |
0 |
0 |
1.000 |
Average: |
322.2 |
-4.6 |
0.663 |
11 |
0 |
0 |
1.000 |
4 |
5 |
|
B |
17 |
5 |
12266 |
◊ |
A |
x-1/2,-y+1/2,-z-1 |
4_454 |
20 |
7 |
12200 |
174.3 |
-1.6 |
0.478 |
1 |
1 |
0 |
0.000 |
5 |
6 |
|
[EDO]A:305 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
17 |
8 |
12200 |
116.1 |
2.8 |
0.427 |
2 |
0 |
0 |
0.000 |
6 |
7 |
|
[EDO]A:304 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
18 |
9 |
12200 |
113.8 |
3.8 |
0.687 |
1 |
0 |
0 |
0.000 |
7 |
8 |
|
[EDO]B:303 |
4 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
20 |
10 |
12266 |
113.6 |
3.7 |
0.701 |
1 |
0 |
0 |
0.000 |
8 |
9 |
|
[EDO]A:311 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
12200 |
110.5 |
3.9 |
0.515 |
2 |
0 |
0 |
0.000 |
9 |
10 |
|
[EDO]A:309 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
20 |
9 |
12200 |
109.3 |
3.1 |
0.462 |
3 |
0 |
0 |
0.000 |
10 |
11 |
|
[EDO]B:302 |
4 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
19 |
11 |
12266 |
109.2 |
3.5 |
0.512 |
2 |
0 |
0 |
0.000 |
11 |
12 |
|
[EDO]A:310 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
12200 |
103.1 |
2.9 |
0.484 |
0 |
0 |
0 |
0.000 |
12 |
13 |
|
[EDO]A:302 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
18 |
12 |
12200 |
98.7 |
2.7 |
0.515 |
1 |
0 |
0 |
0.000 |
13 |
14 |
|
[EDO]B:305 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
21 |
5 |
12266 |
95.5 |
1.8 |
0.240 |
0 |
0 |
0 |
0.000 |
14 |
15 |
|
[EDO]A:307 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
22 |
6 |
12200 |
94.0 |
2.0 |
0.415 |
0 |
0 |
0 |
0.000 |
15 |
16 |
|
[EDO]B:306 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
19 |
8 |
12266 |
89.8 |
1.5 |
0.239 |
0 |
0 |
0 |
0.000 |
16 |
17 |
|
[EDO]A:308 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
12200 |
86.5 |
1.5 |
0.217 |
0 |
0 |
0 |
0.000 |
17 |
18 |
|
[EDO]A:303 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
12200 |
84.7 |
2.3 |
0.431 |
0 |
0 |
0 |
0.000 |
18 |
19 |
|
[EDO]B:304 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
12266 |
79.6 |
1.8 |
0.259 |
2 |
0 |
0 |
0.000 |
19 |
20 |
|
B |
7 |
4 |
12266 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
6 |
2 |
12200 |
70.6 |
-1.3 |
0.265 |
0 |
0 |
0 |
0.000 |
20 |
21 |
|
[EDO]A:306 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
12200 |
59.0 |
1.1 |
0.672 |
1 |
0 |
0 |
0.000 |
21 |
22 |
|
[EDO]B:302 |
3 |
1 |
187 |
f |
[GSH]B:301 |
x,y,z |
1_555 |
6 |
1 |
515 |
42.1 |
-0.6 |
0.720 |
1 |
0 |
0 |
0.150 |
22 |
23 |
|
[EDO]A:302 |
3 |
1 |
183 |
f |
[GSH]A:301 |
x,y,z |
1_555 |
6 |
1 |
514 |
41.9 |
-0.3 |
0.705 |
0 |
0 |
0 |
0.042 |
23 |
24 |
|
[EDO]A:306 |
3 |
1 |
184 |
f |
[GSH]A:301 |
x,y,z |
1_555 |
5 |
1 |
514 |
34.4 |
0.4 |
0.808 |
1 |
0 |
0 |
0.006 |
24 |
25 |
|
[EDO]B:306 |
2 |
1 |
184 |
f |
[EDO]B:305 |
x,y,z |
1_555 |
2 |
1 |
183 |
33.2 |
1.9 |
0.707 |
0 |
0 |
0 |
0.000 |
25 |
26 |
|
[EDO]A:305 |
2 |
1 |
186 |
f |
[GSH]A:301 |
x,y,z |
1_555 |
3 |
1 |
514 |
33.0 |
0.2 |
0.672 |
0 |
0 |
0 |
0.000 |
26 |
27 |
|
[EDO]A:308 |
2 |
1 |
185 |
f |
[EDO]A:307 |
x,y,z |
1_555 |
3 |
1 |
185 |
28.7 |
0.8 |
1.000 |
1 |
0 |
0 |
0.000 |
27 |
28 |
|
[EDO]A:306 |
3 |
1 |
184 |
f |
[EDO]A:302 |
x,y,z |
1_555 |
3 |
1 |
183 |
28.0 |
1.3 |
1.000 |
0 |
0 |
0 |
0.000 |
28 |
29 |
|
[EDO]A:306 |
2 |
1 |
184 |
f |
[EDO]A:303 |
x,y,z |
1_555 |
2 |
1 |
184 |
27.0 |
0.7 |
1.000 |
1 |
0 |
0 |
0.000 |
29 |
30 |
|
[EDO]B:303 |
2 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
12200 |
10.6 |
-0.0 |
0.471 |
0 |
0 |
0 |
0.005 |
30 |
31 |
|
[EDO]A:304 |
2 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
12266 |
8.7 |
-0.0 |
0.493 |
0 |
0 |
0 |
0.000 |
31 |
32 |
|
B |
1 |
1 |
12266 |
f |
[EDO]A:309 |
x-1/2,-y+1/2,-z-1 |
4_454 |
1 |
1 |
184 |
2.3 |
-0.0 |
0.662 |
0 |
0 |
0 |
0.002 |
|